CAS Registry Number: 67878-76-6

Name:

2-​Naphthalenecarboxyli​c acid, 5-​bromo-​, methyl ester
1-​Bromo-​6-​carbomethoxynaphthal​ene; 5-​Bromo-​2-​naphthalenecarboxyli​c acid methyl ester; Methyl 5-​bromo-​2-​naphthoate; Methyl 5-​bromonaphthalene-​2-​carboxylate 

Chemical Formula: C12H9BrO2
Exact Mass: 263.98
Molecular Weight: 265.10
m/z: 263.98 (100.0%), 265.98 (97.7%), 264.98 (13.2%), 266.98 (12.8%), 267.98 (1.2%)
Elemental Analysis: C, 54.37; H, 3.42; Br, 30.14; O, 12.07

InChI: InChI=1S/C12H9BrO2/c1-15-12(14)9-5-6-10-8(7-9)3-2-4-11(10)13/h2-7H,1H3
InChIKey: KNUWUXJWMBRWJM-UHFFFAOYSA-N
Canonical SMILES : COC(=O)C1=CC2=C(C=C1)C(=CC=C2)Br

Specification

98%

1. (1) Oztaskin, Necla; Synthetic Communications 2011, V41(13), P2017-2024 CAPLUS
2. (2) Goldstein, Henri; Helvetica Chimica Acta 1938, V21, P62-6 CAPLUS
3. (3) Alessi, Thomas R.; US 4897405 A 1990 CAPLUS