中文版English

CAS Number: 94838-55-8
tert-butyl 4-aminobenzylcarbamate

Structure

tert-butyl 4-aminobenzylcarbamate
Name: tert-butyl 4-aminobenzylcarbamate
Synonyms:
General Information
Product Number: 94838558

CAS Registry Number 94838-55-8
Name:
Carbamic acid, N-​[(4-​aminophenyl)​methyl]​-​, 1,​1-​dimethylethyl ester
Carbamic acid, [(4-aminophenyl)methyl]-, 1,1-dimethylethyl ester (9CI)
(4-Aminobenzyl)carbamic acid tert-butyl ester
4-(((tert-Butyloxycarbonyl)amino)methyl)aniline
4-[(N-tert-Butoxycarbonylamino)methyl]aniline
4-[(N-tert-Butyloxycarbonyl)amino]benzylamine

 

Chemical Formula: C12H18N2O2
Exact Mass: 222.14
Molecular Weight: 222.28
m/z: 222.14 (100.0%), 223.14 (13.3%), 224.14 (1.3%)

 

InChI:InChI=1S/C12H18N2O2/c1-12(2,3)16-11(15)14-8-9-4-6-10(13)7-5-9/h4-7H,8,13H2,1-3H3,(H,14,15)

InChI Key:UXWQXBSQQHAGMG-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)NCC1=CC=C(C=C1)N

 

Thermal Properties Value Condition Note
Melting Point 113-114 °C   (4)CAS
Melting Point 87-88 °C Solv: ethyl acetate (141-78-6); hexane (110-54-3) (7)CAS
Melting Point 79 °C   (1)CAS
Melting Point 60-64 °C   (6)CAS
Melting Point See full text   (2)CAS

Specification

98%

References
  1. (1) Langolf, Sebastian; ChemMedChem 2011, V6(9), P1581-1586 CAPLUS
  2. (2) Juodaityte, Jovita; Journal of Biotechnology 2004, V112(1-2), P127-138 CAPLUS
  3. (4) Cirauqui, Nuria; Arzneimittel Forschung 2008, V58(11), P585-591 CAPLUS
  4. (6) Katayama, Seiji; Journal of Medicinal Chemistry 2003, V46(5), P691-701 CAPLUS
  5. (7) Liu, Yun-Shan; Journal of Organic Chemistry 1998, V63(10), P3471-3473 CAPLUS
Contact Us
TEL:  86-17758012822
FAX:  86-571-87759731
E-mail:sales@hzchempro.com
[ CLOSE ]