31301-86-7

Name Carbamic acid, [2-hydroxy-1-methyl-2-[3-(phenylmethoxy)phenyl]ethyl]-, phenylmethyl ester, [R-(R*,S*)]- (9CI)
CAS 31301-86-7
Molecular Formula C24H25NO4
Molecular Weight 391.46
MOL File 31301-86-7.mol
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Chemical Properties

Melting point  109-110 °C
Boiling point  592.9±50.0 °C(Predicted)
density  1.193±0.06 g/cm3(Predicted)
pka 11.81±0.46(Predicted)
InChI InChI=1S/C24H25NO4/c1-18(25-24(27)29-17-20-11-6-3-7-12-20)23(26)21-13-8-14-22(15-21)28-16-19-9-4-2-5-10-19/h2-15,18,23,26H,16-17H2,1H3,(H,25,27)/t18-,23-/m0/s1
InChIKey ICQZUTOLLXFSDF-MBSDFSHPSA-N
SMILES C(OCC1=CC=CC=C1)(=O)N[C@@H](C)[C@H](O)C1=CC=CC(OCC2=CC=CC=C2)=C1

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