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Structure

Methyl 4-chlorobenzoylacetate

CAS
53101-00-1
Catalog Number
ACM53101001
Category
Other Products
Molecular Weight
212.63
Molecular Formula
C10H9ClO3

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Specification

Synonyms
590444_ALDRICH, Methyl (4-chlorobenzoyl)acetate, MolPort-000-153-463, ZINC00153862, CID735885, PB319294596, I01-7181, 53101-00-1
IUPAC Name
methyl 3-(4-chlorophenyl)-3-oxopropanoate
Canonical SMILES
COC(=O)CC(=O)C1=CC=C(C=C1)Cl
InChI Key
OIPOJEDRCKVDJK-UHFFFAOYSA-N
Boiling Point
100-106ºC (0.2 mmHg)
Melting Point
42-46ºC(lit.)
Flash Point
125.5ºC
Density
1.255g/cm³
Exact Mass
212.02400
Hazard Statements
Xi
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
S26-S36
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