CAS Registry Number: 171178-41-9

Name:

Carbamic acid, N-​(6-​fluoro-​3-​pyridinyl)​-​, 1,​1-​dimethylethyl ester
Carbamic acid, (6-​fluoro-​3-​pyridinyl)​-​, 1,​1-​dimethylethyl ester (9CI); (6-​Fluoropyridin-​3-​yl)​carbamic acid tert-​butyl ester 

Chemical Formula: C10H13FN2O2
Exact Mass: 212.10
Molecular Weight: 212.22
m/z: 212.10 (100.0%), 213.10 (11.0%), 214.10 (1.0%)
Elemental Analysis: C, 56.60; H, 6.17; F, 8.95; N, 13.20; O, 15.08

InChI: InChI=1S/C10H13FN2O2/c1-10(2,3)15-9(14)13-7-4-5-8(11)12-6-7/h4-6H,1-3H3,(H,13,14)
InChIKey: FXGNEIOGSGKPFL-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)OC(=O)NC1=CN=C(C=C1)F

Specification

98%

1. (1) Rewcastle, Gordon W.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry 1996, (18), P2221-2226 CAPLUS
2. (2) Zhang, Yinsheng; Journal of Labelled Compounds & Radiopharmaceuticals 2005, V48(7), P485-496 CAPLUS