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Cumarinas y derivados

Compuestos orgánicos aromáticos que contienen un anillo de benceno con dos átomos de hidrógeno adyacentes reemplazados por una cadena similar a la lactona, que forman un segundo heterociclo de seis miembros que comparte dos carbonos con el anillo de benceno con la fórmula: C9H6O2.
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1 – 15 de 116 resultados
1

Cumarina, 98 %, Thermo Scientific Chemicals

CAS: 91-64-5 Fórmula molecular: C9H6O2 Peso molecular (g/mol): 146.15 Número MDL: MFCD00006850 Clave InChI: ZYGHJZDHTFUPRJ-UHFFFAOYSA-N Sinónimo: coumarin,2h-chromen-2-one,2h-1-benzopyran-2-one,cumarin,1,2-benzopyrone,rattex,tonka bean camphor,coumarinic anhydride,coumarine,benzo-alpha-pyrone PubChem CID: 323 ChEBI: CHEBI:28794 SMILES: O=C1OC2=CC=CC=C2C=C1

Sinónimo coumarin,2h-chromen-2-one,2h-1-benzopyran-2-one,cumarin,1,2-benzopyrone,rattex,tonka bean camphor,coumarinic anhydride,coumarine,benzo-alpha-pyrone
Clave InChI ZYGHJZDHTFUPRJ-UHFFFAOYSA-N
PubChem CID 323
Fórmula molecular C9H6O2
CAS 91-64-5
ChEBI CHEBI:28794
Peso molecular (g/mol) 146.15
Número MDL MFCD00006850
SMILES O=C1OC2=CC=CC=C2C=C1
2

Thermo Scientific Chemicals 7-Amino-4-metilcumarina, 98 %

CAS: 26093-31-2 Fórmula molecular: C10H9NO2 Peso molecular (g/mol): 175.19 Número MDL: MFCD00006868 Clave InChI: GLNDAGDHSLMOKX-UHFFFAOYSA-N Sinónimo: 7-amino-4-methylcoumarin,coumarin 120,7-amino-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-methyl,coumarin, 7-amino-4-methyl,4-methyl-7-aminocoumarin,7-amino-4-methyl-chromen-2-one,unii-ocy3jct44x,ccris 4961,ocy3jct44x PubChem CID: 92249 ChEBI: CHEBI:51771 Nombre IUPAC: 7-amino-4-metilcromen-2-ona SMILES: CC1=CC(=O)OC2=CC(N)=CC=C12

Sinónimo 7-amino-4-methylcoumarin,coumarin 120,7-amino-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-methyl,coumarin, 7-amino-4-methyl,4-methyl-7-aminocoumarin,7-amino-4-methyl-chromen-2-one,unii-ocy3jct44x,ccris 4961,ocy3jct44x
Clave InChI GLNDAGDHSLMOKX-UHFFFAOYSA-N
PubChem CID 92249
Fórmula molecular C10H9NO2
CAS 26093-31-2
ChEBI CHEBI:51771
Peso molecular (g/mol) 175.19
Número MDL MFCD00006868
SMILES CC1=CC(=O)OC2=CC(N)=CC=C12
Nombre IUPAC 7-amino-4-metilcromen-2-ona
3

7-Amino-4-metilcumarina, 98 %, Thermo Scientific Chemicals

CAS: 26093-31-2 Fórmula molecular: C10H9NO2 Peso molecular (g/mol): 175.19 Número MDL: MFCD00006868 Clave InChI: GLNDAGDHSLMOKX-UHFFFAOYSA-N Sinónimo: 7-amino-4-methylcoumarin,coumarin 120,7-amino-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-methyl,coumarin, 7-amino-4-methyl,4-methyl-7-aminocoumarin,7-amino-4-methyl-chromen-2-one,unii-ocy3jct44x,ccris 4961,ocy3jct44x PubChem CID: 92249 ChEBI: CHEBI:51771 Nombre IUPAC: 7-amino-4-metilcromen-2-ona SMILES: CC1=CC(=O)OC2=CC(N)=CC=C12

Sinónimo 7-amino-4-methylcoumarin,coumarin 120,7-amino-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-methyl,coumarin, 7-amino-4-methyl,4-methyl-7-aminocoumarin,7-amino-4-methyl-chromen-2-one,unii-ocy3jct44x,ccris 4961,ocy3jct44x
Clave InChI GLNDAGDHSLMOKX-UHFFFAOYSA-N
PubChem CID 92249
Fórmula molecular C10H9NO2
CAS 26093-31-2
ChEBI CHEBI:51771
Peso molecular (g/mol) 175.19
Número MDL MFCD00006868
SMILES CC1=CC(=O)OC2=CC(N)=CC=C12
Nombre IUPAC 7-amino-4-metilcromen-2-ona
4

4-(5-bromotien-2-il)piridina, 97 %, Thermo Scientific™

CAS: 2199-93-1 Fórmula molecular: C11H7BrO3 Peso molecular (g/mol): 267.08 Número MDL: MFCD00024075 Clave InChI: XFQYOFLFNKCHLG-UHFFFAOYSA-N Sinónimo: 3-acetyl-6-bromocoumarin,3-acetyl-6-bromo-2h-chromen-2-one,3-acetyl-6-bromo-chromen-2-one,2h-1-benzopyran-2-one,3-acetyl-6-bromo,3-acetyl-6-bromo-2-oxochromene,pubchem13336,maybridge1_000212,zerenex e/1034014,6-bromanyl-3-ethanoyl-chromen-2-one PubChem CID: 304813 Nombre IUPAC: 3-acetil-6-bromocromen-2-ona SMILES: CC(=O)C1=CC2=CC(Br)=CC=C2OC1=O

Sinónimo 3-acetyl-6-bromocoumarin,3-acetyl-6-bromo-2h-chromen-2-one,3-acetyl-6-bromo-chromen-2-one,2h-1-benzopyran-2-one,3-acetyl-6-bromo,3-acetyl-6-bromo-2-oxochromene,pubchem13336,maybridge1_000212,zerenex e/1034014,6-bromanyl-3-ethanoyl-chromen-2-one
Clave InChI XFQYOFLFNKCHLG-UHFFFAOYSA-N
PubChem CID 304813
Fórmula molecular C11H7BrO3
CAS 2199-93-1
Peso molecular (g/mol) 267.08
Número MDL MFCD00024075
SMILES CC(=O)C1=CC2=CC(Br)=CC=C2OC1=O
Nombre IUPAC 3-acetil-6-bromocromen-2-ona
5

4-Metilumbeliferona, 97 %, Thermo Scientific Chemicals

CAS: 90-33-5 Fórmula molecular: C10H8O3 Peso molecular (g/mol): 176.17 Número MDL: MFCD00006866 Clave InChI: HSHNITRMYYLLCV-UHFFFAOYSA-N Sinónimo: 4-methylumbelliferone,hymecromone,7-hydroxy-4-methylcoumarin,imecromone,7-hydroxy-4-methyl-2h-chromen-2-one,cholestil,mendiaxon,4-methyl-7-hydroxycoumarin,beta-methylumbelliferone,bilcolic PubChem CID: 5280567 ChEBI: CHEBI:17224 Nombre IUPAC: 7-hidroxi-4-metilcromen-2-ona SMILES: CC1=CC(=O)OC2=CC(O)=CC=C12

EDGE
Sinónimo 4-methylumbelliferone,hymecromone,7-hydroxy-4-methylcoumarin,imecromone,7-hydroxy-4-methyl-2h-chromen-2-one,cholestil,mendiaxon,4-methyl-7-hydroxycoumarin,beta-methylumbelliferone,bilcolic
Clave InChI HSHNITRMYYLLCV-UHFFFAOYSA-N
PubChem CID 5280567
Fórmula molecular C10H8O3
CAS 90-33-5
ChEBI CHEBI:17224
Peso molecular (g/mol) 176.17
Número MDL MFCD00006866
SMILES CC1=CC(=O)OC2=CC(O)=CC=C12
Nombre IUPAC 7-hidroxi-4-metilcromen-2-ona
6

7-Hidroxi-4-(trifluorometil)cumarina, 98 %, Thermo Scientific Chemicals

CAS: 575-03-1 Fórmula molecular: C10H5F3O3 Peso molecular (g/mol): 230.142 Número MDL: MFCD00037578 Clave InChI: CCKWMCUOHJAVOL-UHFFFAOYSA-N Sinónimo: 7-hydroxy-4-trifluoromethyl coumarin,7-hydroxy-4-trifluoromethylcoumarin,7-hydroxy-4-trifluoromethyl-2h-chromen-2-one,7-hydroxy-4-trifluoromethyl chromen-2-one,4-trifluoromethyl umbelliferone,7-hydroxy-4-trifluoromethyl-chromen-2-one,2h-1-benzopyran-2-one, 7-hydroxy-4-trifluoromethyl,7,4-hfc,maybridge1_006885,tfmu PubChem CID: 5375667 Nombre IUPAC: 7-hidroxi-4-(trifluorometil)cromen-2-ona SMILES: C1=CC2=C(C=C1O)OC(=O)C=C2C(F)(F)F

EDGE
Sinónimo 7-hydroxy-4-trifluoromethyl coumarin,7-hydroxy-4-trifluoromethylcoumarin,7-hydroxy-4-trifluoromethyl-2h-chromen-2-one,7-hydroxy-4-trifluoromethyl chromen-2-one,4-trifluoromethyl umbelliferone,7-hydroxy-4-trifluoromethyl-chromen-2-one,2h-1-benzopyran-2-one, 7-hydroxy-4-trifluoromethyl,7,4-hfc,maybridge1_006885,tfmu
Clave InChI CCKWMCUOHJAVOL-UHFFFAOYSA-N
PubChem CID 5375667
Fórmula molecular C10H5F3O3
CAS 575-03-1
Peso molecular (g/mol) 230.142
Número MDL MFCD00037578
SMILES C1=CC2=C(C=C1O)OC(=O)C=C2C(F)(F)F
Nombre IUPAC 7-hidroxi-4-(trifluorometil)cromen-2-ona
7

Escopoletina, 95 %, Thermo Scientific Chemicals

CAS: 92-61-5 Fórmula molecular: C10H8O4 Peso molecular (g/mol): 192.17 Número MDL: MFCD00006872 Clave InChI: RODXRVNMMDRFIK-UHFFFAOYSA-N Sinónimo: scopoletin,gelseminic acid,6-methylesculetin,7-hydroxy-6-methoxy-2h-chromen-2-one,chrysatropic acid,scopoletine,murrayetin,scopoletol,7-hydroxy-6-methoxycoumarin,6-o-methylesculetin PubChem CID: 5280460 ChEBI: CHEBI:17488 Nombre IUPAC: 7-hidroxi-6-metoxicromen-2-ona SMILES: COC1=C(C=C2C(=C1)C=CC(=O)O2)O

Sinónimo scopoletin,gelseminic acid,6-methylesculetin,7-hydroxy-6-methoxy-2h-chromen-2-one,chrysatropic acid,scopoletine,murrayetin,scopoletol,7-hydroxy-6-methoxycoumarin,6-o-methylesculetin
Clave InChI RODXRVNMMDRFIK-UHFFFAOYSA-N
PubChem CID 5280460
Fórmula molecular C10H8O4
CAS 92-61-5
ChEBI CHEBI:17488
Peso molecular (g/mol) 192.17
Número MDL MFCD00006872
SMILES COC1=C(C=C2C(=C1)C=CC(=O)O2)O
Nombre IUPAC 7-hidroxi-6-metoxicromen-2-ona
8

Hidrato de esculina, 97 %, Thermo Scientific Chemicals

CAS: 531-75-9 Fórmula molecular: C15H16O9 Peso molecular (g/mol): 340.28 Número MDL: MFCD00149492 Clave InChI: XHCADAYNFIFUHF-TYKRLAFXNA-N Sinónimo: esculin,aesculin,esculoside,--esculin,polychrome,6,7-dihydroxycoumarin-6-o-glucoside,aesculinum,esculine,esculetin 6-o-glucoside,6,7-dihydroxycoumarin 6-glucoside PubChem CID: 5281417 ChEBI: CHEBI:4853 Nombre IUPAC: 7-hidroxi-6-[(2S,3R,4S,5S,6R)-3,4,5-trihidroxi-6-(hidroximetil)oxan-2-il]oxicromen-2-ona SMILES: OC[C@H]1O[C@@H](OC2=C(O)C=C3OC(=O)C=CC3=C2)[C@H](O)[C@@H](O)[C@@H]1O

Sinónimo esculin,aesculin,esculoside,--esculin,polychrome,6,7-dihydroxycoumarin-6-o-glucoside,aesculinum,esculine,esculetin 6-o-glucoside,6,7-dihydroxycoumarin 6-glucoside
Clave InChI XHCADAYNFIFUHF-TYKRLAFXNA-N
PubChem CID 5281417
Fórmula molecular C15H16O9
CAS 531-75-9
ChEBI CHEBI:4853
Peso molecular (g/mol) 340.28
Número MDL MFCD00149492
SMILES OC[C@H]1O[C@@H](OC2=C(O)C=C3OC(=O)C=CC3=C2)[C@H](O)[C@@H](O)[C@@H]1O
Nombre IUPAC 7-hidroxi-6-[(2S,3R,4S,5S,6R)-3,4,5-trihidroxi-6-(hidroximetil)oxan-2-il]oxicromen-2-ona
9

4-Metilumbeliferil fosfato, 99 %, Thermo Scientific Chemicals

CAS: 3368-04-5 Número MDL: MFCD00016969

CAS 3368-04-5
Número MDL MFCD00016969
11

3-Acetilcumarina, +98 %, Thermo Scientific Chemicals

CAS: 3949-36-8 Fórmula molecular: C11H8O3 Peso molecular (g/mol): 188.182 Número MDL: MFCD00006853 Clave InChI: CSPIFKKOBWYOEX-UHFFFAOYSA-N Sinónimo: 3-acetylcoumarin,3-acetyl-2h-chromen-2-one,coumarin, 3-acetyl,2h-1-benzopyran-2-one, 3-acetyl,3-acetyl-2-oxochromene,3-acetylcoumarine,pubchem8664,maybridge1_000885,prestwick0_000891,prestwick1_000891 PubChem CID: 77553 Nombre IUPAC: 3-acetilcromon-2-ona SMILES: CC(=O)C1=CC2=CC=CC=C2OC1=O

Sinónimo 3-acetylcoumarin,3-acetyl-2h-chromen-2-one,coumarin, 3-acetyl,2h-1-benzopyran-2-one, 3-acetyl,3-acetyl-2-oxochromene,3-acetylcoumarine,pubchem8664,maybridge1_000885,prestwick0_000891,prestwick1_000891
Clave InChI CSPIFKKOBWYOEX-UHFFFAOYSA-N
PubChem CID 77553
Fórmula molecular C11H8O3
CAS 3949-36-8
Peso molecular (g/mol) 188.182
Número MDL MFCD00006853
SMILES CC(=O)C1=CC2=CC=CC=C2OC1=O
Nombre IUPAC 3-acetilcromon-2-ona
12

6,7-Dihydroxycoumarin, 98+%

CAS: 305-01-1 Fórmula molecular: C9H6O4 Peso molecular (g/mol): 178.143 Número MDL: MFCD00006874 Clave InChI: ILEDWLMCKZNDJK-UHFFFAOYSA-N Sinónimo: esculetin,6,7-dihydroxycoumarin,aesculetin,cichorigenin,6,7-dihydroxy-2h-chromen-2-one,cichoriin aglucon,esculatin,esculetol,esculin aglucon,esculin aglycon PubChem CID: 5281416 ChEBI: CHEBI:490095 Nombre IUPAC: 6,7-dihydroxychromen-2-one SMILES: C1=CC(=O)OC2=CC(=C(C=C21)O)O

Sinónimo esculetin,6,7-dihydroxycoumarin,aesculetin,cichorigenin,6,7-dihydroxy-2h-chromen-2-one,cichoriin aglucon,esculatin,esculetol,esculin aglucon,esculin aglycon
Clave InChI ILEDWLMCKZNDJK-UHFFFAOYSA-N
PubChem CID 5281416
Fórmula molecular C9H6O4
CAS 305-01-1
ChEBI CHEBI:490095
Peso molecular (g/mol) 178.143
Número MDL MFCD00006874
SMILES C1=CC(=O)OC2=CC(=C(C=C21)O)O
Nombre IUPAC 6,7-dihydroxychromen-2-one
13

7,8-Dihidroxi-4-metilcumarina, 97 %, Thermo Scientific Chemicals

CAS: 2107-77-9 Fórmula molecular: C10H8O4 Peso molecular (g/mol): 192.17 Número MDL: MFCD00016972 Clave InChI: NWQBYMPNIJXFNQ-UHFFFAOYSA-N Sinónimo: 7,8-dihydroxy-4-methylcoumarin,4-methyldaphnetin,7,8-dihydroxy-4-methyl-2h-chromen-2-one,4-methyldaphnetine,4-methyl-7,8-dihydroxycoumarin,2h-1-benzopyran-2-one, 7,8-dihydroxy-4-methyl,coumarin, 7,8-dihydroxy-4-methyl,7,8-dihydroxy-4-methyl-2h-1-benzopyran-2-one,7,8-dihydroxy-4-methyl-chromen-2-one,7,8-dihydroxy-4-methyl-2-benzopyrone PubChem CID: 5355836 SMILES: CC1=CC(=O)OC2=C(O)C(O)=CC=C12

Sinónimo 7,8-dihydroxy-4-methylcoumarin,4-methyldaphnetin,7,8-dihydroxy-4-methyl-2h-chromen-2-one,4-methyldaphnetine,4-methyl-7,8-dihydroxycoumarin,2h-1-benzopyran-2-one, 7,8-dihydroxy-4-methyl,coumarin, 7,8-dihydroxy-4-methyl,7,8-dihydroxy-4-methyl-2h-1-benzopyran-2-one,7,8-dihydroxy-4-methyl-chromen-2-one,7,8-dihydroxy-4-methyl-2-benzopyrone
Clave InChI NWQBYMPNIJXFNQ-UHFFFAOYSA-N
PubChem CID 5355836
Fórmula molecular C10H8O4
CAS 2107-77-9
Peso molecular (g/mol) 192.17
Número MDL MFCD00016972
SMILES CC1=CC(=O)OC2=C(O)C(O)=CC=C12
14

4-Metoxicoumarina, 98 %, Thermo Scientific Chemicals

CAS: 20280-81-3 Fórmula molecular: C10H8O3 Peso molecular (g/mol): 176.171 Número MDL: MFCD00017349 Clave InChI: MLCMXDYMSAZNPC-UHFFFAOYSA-N PubChem CID: 529426 Nombre IUPAC: 4-metoxicromen-2-ona SMILES: COC1=CC(=O)OC2=CC=CC=C21

Clave InChI MLCMXDYMSAZNPC-UHFFFAOYSA-N
PubChem CID 529426
Fórmula molecular C10H8O3
CAS 20280-81-3
Peso molecular (g/mol) 176.171
Número MDL MFCD00017349
SMILES COC1=CC(=O)OC2=CC=CC=C21
Nombre IUPAC 4-metoxicromen-2-ona
15

Ácido 7-hidroxicoumarinil-4-acético, 97 %, Thermo Scientific Chemicals

CAS: 6950-82-9 Fórmula molecular: C11H8O5 Peso molecular (g/mol): 220.18 Número MDL: MFCD00037563 Clave InChI: BNHPMQBVNXMPDU-UHFFFAOYSA-N Sinónimo: 7-hydroxycoumarin-4-acetic acid,2-7-hydroxy-2-oxo-2h-chromen-4-yl acetic acid,umbelliferone-4-acetic acid,7-hydroxy-2-oxo-2h-1-benzopyran-4-acetic acid,chembl12253,2-7-hydroxy-2-oxochromen-4-yl acetic acid,7-hydroxy-4-coumarinylacetic acid,2h-1-benzopyran-4-acetic acid, 7-hydroxy-2-oxo,7-hydroxycoumarin-4-yl acetic acid,7-hydroxy-2-oxochromen-4-yl acetic acid PubChem CID: 5338490 Nombre IUPAC: ácido 2-(7-hidroxi-2-oxocromen-4-il)acético SMILES: C1=CC2=C(C=C1O)OC(=O)C=C2CC(=O)O

Sinónimo 7-hydroxycoumarin-4-acetic acid,2-7-hydroxy-2-oxo-2h-chromen-4-yl acetic acid,umbelliferone-4-acetic acid,7-hydroxy-2-oxo-2h-1-benzopyran-4-acetic acid,chembl12253,2-7-hydroxy-2-oxochromen-4-yl acetic acid,7-hydroxy-4-coumarinylacetic acid,2h-1-benzopyran-4-acetic acid, 7-hydroxy-2-oxo,7-hydroxycoumarin-4-yl acetic acid,7-hydroxy-2-oxochromen-4-yl acetic acid
Clave InChI BNHPMQBVNXMPDU-UHFFFAOYSA-N
PubChem CID 5338490
Fórmula molecular C11H8O5
CAS 6950-82-9
Peso molecular (g/mol) 220.18
Número MDL MFCD00037563
SMILES C1=CC2=C(C=C1O)OC(=O)C=C2CC(=O)O
Nombre IUPAC ácido 2-(7-hidroxi-2-oxocromen-4-il)acético