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Clorhidrato de rolapitant, TRC

Código de producto. 30412030
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Cantidad:
1 mg
Unit Size:
1 miligramo
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30412030 1 mg 1 miligramo
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Product Code. 30412030 Supplier Toronto Research Chemicals Supplier No. TRCR6398001MG

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Specifications

Nombre del producto químico o material Rolapitant hydrochloride
CAS 858102-79-1
Fórmula molecular C25 H26 F6 N2 O2 . Cl H
Cantidad 1 mg
Sinónimo 1,7-Diazaspiro[4.5]decan-2-one','8-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-8-phenyl-','hydrochloride (1:1)','(5S,8S)-, 1,7-Diazaspiro[4.5]decan-2-one','8-[[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]methyl]-8-phenyl-','monohydrochloride','(5S,8S)- (9CI), Rolapitant hydrochloride, Sch 619734
Fórmula InChI InChI=1S/C25H26F6N2O2.ClH/c1-16(17-11-19(24(26,27)28)13-20(12-17)25(29,30)31)35-15-23(18-5-3-2-4-6-18)10-9-22(14-32-23)8-7-21(34)33-22;/h2-6,11-13,16,32H,7-10,14-15H2,1H3,(H,33,34);1H/t16-,22-,23-;/m1./s1
SMILES Cl.C[C@@H](OC[C@]1(CC[C@]2(CCC(=O)N2)CN1)c3ccccc3)c4cc(cc(c4)C(F)(F)F)C(F)(F)F
Nombre IUPAC (5S,8S)-8-[[(1R)-1-[3,5-bis(trifluorometil)fenil]etoxi]metil]-8-fenil-1,9-diazaspiro[4.5]decan-2-ona;clorhidrato
Peso molecular (g/mol) 536.94
Formula Weight (peso de la fórmula) 536.1665
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