4-Chloroacetoacetyl chloride

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C4H4Cl2O2
Molecular Weight	154.979
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-Chloroacetoacetyl chloride

Structure Search

SMILES

ClCC(=O)CC(Cl)=O

InChI

InChIKey=WSHVQVCBPLNREW-UHFFFAOYSA-N

InChI=1S/C4H4Cl2O2/c5-2-3(7)1-4(6)8/h1-2H2

HIDE SMILES / InChI

Molecular Formula	C4H4Cl2O2
Molecular Weight	154.979
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 17:42:37 GMT 2025` Edited by `admin` on `Tue Apr 01 17:42:37 GMT 2025`
Record UNII	FDJ3RDX5VF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-Chloro-3-oxobutyryl chloride

Preferred Name

English

4-Chloroacetoacetyl chloride

Systematic Name

English

?-Chloroacetoacetyl chloride

Systematic Name

English

Butanoyl chloride, 4-chloro-3-oxo-

Systematic Name

English

4-Chloro-3-oxobutanoyl chloride

Systematic Name

English

Code System Code Type Description

FDA UNII

FDJ3RDX5VF

Created by admin on Tue Apr 01 17:42:37 GMT 2025 , Edited by admin on Tue Apr 01 17:42:37 GMT 2025

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PUBCHEM

3016262

Created by admin on Tue Apr 01 17:42:37 GMT 2025 , Edited by admin on Tue Apr 01 17:42:37 GMT 2025

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ECHA (EC/EINECS)

255-301-1

Created by admin on Tue Apr 01 17:42:37 GMT 2025 , Edited by admin on Tue Apr 01 17:42:37 GMT 2025

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CAS

41295-64-1

Created by admin on Tue Apr 01 17:42:37 GMT 2025 , Edited by admin on Tue Apr 01 17:42:37 GMT 2025

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EPA CompTox

DTXSID90194280

Created by admin on Tue Apr 01 17:42:37 GMT 2025 , Edited by admin on Tue Apr 01 17:42:37 GMT 2025

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