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CAS Number: 645391-89-5
(S)-benzyl (1-(4-hydroxyphenyl)ethyl)carbamate

Structure

(S)-benzyl (1-(4-hydroxyphenyl)ethyl)carbamate
Name: (S)-benzyl (1-(4-hydroxyphenyl)ethyl)carbamate
Synonyms:
General Information
Product Number: 645391895
CAS Registry Number: 645391-89-5
Name:
        Carbamic acid, N-​[(1S)​-​1-​(4-​hydroxyphenyl)​ethyl]​-​, phenylmethyl ester
        Carbamic acid, [(1S)​-​1-​(4-​hydroxyphenyl)​ethyl]​-​, phenylmethyl ester (9CI) 
 
Chemical Formula: C16H17NO3
Exact Mass: 271.12
Molecular Weight: 271.31
m/z: 271.12 (100.0%), 272.12 (17.7%), 273.13 (2.1%)
Elemental Analysis: C, 70.83; H, 6.32; N, 5.16; O, 17.69
 
InChI: InChI=1S/C16H17NO3/c1-12(14-7-9-15(18)10-8-14)17-16(19)20-11-13-5-3-2-4-6-13/h2-10,12,18H,11H2,1H3,(H,17,19)/t12-/m0/s1
InChIKey: MOFFBMMMWZMROW-LBPRGKRZSA-N
Canonical SMILES : CC(C1=CC=C(C=C1)O)NC(=O)OCC2=CC=CC=C2
Isomeric SMILES: C[C@@H](C1=CC=C(C=C1)O)NC(=O)OCC2=CC=CC=C2

Specification

98%

References

PCT Int. Appl. (2008), WO 2008006044 A2 20080110.

PCT Int. Appl. (2004), WO 2004004655 A2 20040115. 

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