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Structure

5-(3-Bromo-4-methylphenyl)-5-oxovaleric acid

CAS
898767-16-3
Catalog Number
ACM898767163
Category
Other Products
Molecular Weight
285.13
Molecular Formula
C12H13BrO3

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Specification

Synonyms
5-(3-BROMO-4-METHYLPHENYL)-5-OXOVALERIC ACID
IUPAC Name
5-(3-bromo-4-methylphenyl)-5-oxopentanoic acid
Canonical SMILES
CC1=C(C=C(C=C1)C(=O)CCCC(=O)O)Br
InChI Key
DTQYIFPSTDECKF-UHFFFAOYSA-N
Boiling Point
453.4ºC at 760 mmHg
Flash Point
228ºC
Density
1.443g/cm³
Exact Mass
284.00500
H-Bond Acceptor
3
H-Bond Donor
1
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