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CAS Number: 213598-20-0
3-bromo-4-isopropoxybenzoic acid

Structure

 3-bromo-4-isopropoxybenzoic acid
Name: 3-bromo-4-isopropoxybenzoic acid
Synonyms:
General Information
Product Number: 213598200

CAS Registry Number 213598-20-0
Name:
Benzoic acid, 3-?bromo-?4-?(1-?methylethoxy)?-
3-Bromo-4-isopropoxybenzoic acid
4-Isopropoxy-3-bromobenzoic acid

 

Chemical Formula: C10H11BrO3
Exact Mass: 257.99
Molecular Weight: 259.10
m/z: 257.99 (100.0%), 259.99 (97.9%), 258.99 (10.9%), 260.99 (10.8%), 261.99 (1.1%)

 

InChI:InChI=1S/C10H11BrO3/c1-6(2)14-9-4-3-7(10(12)13)5-8(9)11/h3-6H,1-2H3,(H,12,13)

InChI Key:NRSJYUSYBNFGAK-UHFFFAOYSA-N

Canonical SMILES:CC(C)OC1=C(C=C(C=C1)C(=O)O)Br

Specification

98%
References

PCT Int. Appl. (2013), WO 2013093842 A1 20130627.

PCT Int. Appl. (2011), WO 2011060392 A1 20110519. 
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