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CAS Number: 179321-49-4
tert-butyl (4-oxocyclohexyl)carbamate

Structure

tert-butyl (4-oxocyclohexyl)carbamate
Name: tert-butyl (4-oxocyclohexyl)carbamate
Synonyms:
General Information
Product Number: 179321494
CAS Registry Number:
179321-49-4
Name:
Carbamic acid, N-(4-oxocyclohexyl)-, 1,1-dimethylethyl ester
Carbamic acid, (4-oxocyclohexyl)-, 1,1-dimethylethyl ester (9CI); (4-Oxocyclohexyl)carbamic acid tert-butyl ester; 1,1-Dimethylethyl (4-oxocyclohexyl)carbamate; 4-(tert-Butoxycarbonylamino)cyclohexanone; 4-(tert-Butyloxycarbonylamino)cyclohexanone; N-(4-Oxocyclohexyl)carbamic acid tert-butyl ester; tert-Butyl (4-oxocyclohexyl)carbamate; tert-Butyl N-(4-oxocyclohexyl)carbamate 
 
Chemical Formula: C11H19NO3
Exact Mass: 213.14
Molecular Weight: 213.27
m/z: 213.14 (100.0%), 214.14 (12.2%), 215.14 (1.3%)
Elemental Analysis: C, 61.95; H, 8.98; N, 6.57; O, 22.51
 
InChI: InChI=1S/C11H19NO3/c1-11(2,3)15-10(14)12-8-4-6-9(13)7-5-8/h8H,4-7H2,1-3H3,(H,12,14)
InChIKey: WYVFPGFWUKBXPZ-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)OC(=O)NC1CCC(=O)CC1
 
 
Thermal Properties Value Condition Note
Melting Point 97-98 °C   (1)CAS

Specification

98%

References
  1. (1) Noguchi, Hirohide; Heterocycles 2002, V58, P471-504 CAPLUS
  2. (2) Gregg, Brian T.; Journal of Organic Chemistry 2007, V72(15), P5890-5893 CAPLUS
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