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Structure

3-Oxo-3-(2,4,6-trimethylphenyl)propionic acid

CAS
54458-28-5
Catalog Number
ACM54458285
Category
Other Products
Molecular Weight
206.23776
Molecular Formula
C12H14O3

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Specification

Synonyms
MolPort-000-157-927, NSC227213, CID313335, ZINC01757675, 54458-28-5
IUPAC Name
ethyl 3-oxo-3-(2,4,6-trimethylphenyl)propanoate
Canonical SMILES
CCOC(=O)CC(=O)C1=C(C=C(C=C1C)C)C
InChI Key
JKDAOORMLXVMGQ-UHFFFAOYSA-N
Boiling Point
326.5ºC at 760 mmHg
Flash Point
140.6ºC
Density
1.051g/cm³
Exact Mass
234.12600
H-Bond Acceptor
3
H-Bond Donor
0
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