CAS:76008-73-6 / ethyl 5-bromo-2-chlorobenzoate--Hangzhou Chempro Technology Co., Ltd.

CAS Number: 76008-73-6
ethyl 5-bromo-2-chlorobenzoate

Structure
Name: ethyl 5-bromo-2-chlorobenzoate
Synonyms:

General Information

Product Number: 76008736

CAS Registry Number: 76008-73-6

Name:

Benzoic acid, 5-bromo-2-chloro-, ethyl ester

5-Bromo-2-chlorobenzoic acid ethyl ester; Ethyl 5-bromo-2-chlorobenzoate

Chemical Formula: C9H8BrClO2

Exact Mass: 261.94

Molecular Weight: 263.52

m/z: 263.94 (100.0%), 261.94 (77.1%), 265.93 (24.0%), 264.94 (9.9%), 262.94 (7.6%), 266.94 (2.4%)

Elemental Analysis: C, 41.02; H, 3.06; Br, 30.32; Cl, 13.45; O, 12.14

InChI: InChI=1S/C9H8BrClO2/c1-2-13-9(12)7-5-6(10)3-4-8(7)11/h3-5H,2H2,1H3

InChIKey: AMGWDYLEMSMUIO-UHFFFAOYSA-N

Canonical SMILES : CCOC(=O)C1=C(C=CC(=C1)Br)Cl

Thermal Properties	Value	Condition	Note
Boiling Point	128-130 °C	Press: 1 Torr	(1)IC

Specification

98%

References

(1) Banerjee, Amalendu; Journal of the Indian Chemical Society 1980, V57(6), P640-2 CAPLUS
(2) AIST: Integrated Spectral Database System of Organic Compounds. (Data were obtained from the National Institute of Advanced Industrial Science and Technology (Japan))
(3) Shi, Yongheng; Chinese Journal of Chemistry 2011, V29(6), P1192-1198 CAPLUS

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