N-(2-chloroacetyl)-3-oxobutanamide

Modify Date: 2025-08-25 12:55:48

N-(2-chloroacetyl)-3-oxobutanamide Structure
N-(2-chloroacetyl)-3-oxobutanamide structure
 Common Name N-(2-chloroacetyl)-3-oxobutanamide
CAS Number 82437-53-4 Molecular Weight 177.58600
Density 1.276g/cm3 Boiling Point 319.7ºC at 760 mmHg
Molecular Formula C6H8ClNO3 Melting Point 105-115ºC
MSDS N/A Flash Point 147.1ºC

 Names

Name N-(2-chloroacetyl)-3-oxobutanamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.276g/cm3
Boiling Point 319.7ºC at 760 mmHg
Melting Point 105-115ºC
Molecular Formula C6H8ClNO3
Molecular Weight 177.58600
Flash Point 147.1ºC
Exact Mass 177.01900
PSA 63.24000
LogP 0.23800
Index of Refraction 1.463
InChIKey CXMKTWWKRRUSLH-UHFFFAOYSA-N
SMILES CC(=O)CC(=O)NC(=O)CCl

 Synthetic Route

2,2,6-Trimethyl-4H-1,3-dioxin-4-one structure

2,2,6-Trimethyl...

CAS#:5394-63-8

2-Chloroacetamide structure

2-Chloroacetamide

CAS#:79-07-2

~87%

N-(2-chloroacetyl)-3-oxobutanamide Structure

N-(2-chloroacet...

CAS#:82437-53-4

Literature: Sato, Masayuki; Kanuma, Norio; Kato, Tetsuzo Chemical & Pharmaceutical Bulletin, 1982 , vol. 30, # 4 p. 1315 - 1321

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

3-oxobutanoic acid chloroacetamide
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