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1-phenylethyl 4-chloro-3-oxobutanoate

1-phenylethyl 4-chloro-3-oxobutanoate structure

CAS No:
53066-01-6
Formula:
C12H13ClO3
Chemical Name:
1-phenylethyl 4-chloro-3-oxobutanoate
Synonyms:
53066-01-6;1-phenylethyl 4-chloro-3-oxobutanoate;NSC179960;DTXSID00306812;NSC-179960

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1-phenylethyl 4-chloro-3-oxobutanoate Basic Attributes

Molecular Weight：

240.68 g/mol

Exact Mass：

240.0553220 g/mol

NSC Number：

179960

DSSTox ID：

DTXSID00306812

Characteristics

PSA：

43.4 Å²

Computed Properties

Molecular Weight:240.68
XLogP3:2.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:240.0553220
Monoisotopic Mass:240.0553220
Topological Polar Surface Area:43.4
Heavy Atom Count:16
Complexity:247
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1-Phenylethyl 3-methylbutanoate Formula

56961-73-0
Butanoic acid, 2-chloro-3-oxo-, 1-phenylethyl ester Formula

68683-30-7
1-Phenylethyl 2-methylbutanoate Formula

87708-44-9
octyl 4-chloro-3-oxobutanoate Structure

41051-21-2
1-Methylethyl 4-chloro-3-oxobutanoate Structure

41051-20-1
What is 1-phenylethyl N-(4-methylphenyl)sulfonylcarbamate

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What is Acetic acid, 2-chloro-, 1-phenylethyl ester

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Guide of 1-phenylethyl 4-chloro-3-oxobutanoate

Basic Attributes
Characteristics
Computed Properties
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