2-Chlorocrotonic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C4H5ClO2
Molecular Weight	120.534
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 2-Chlorocrotonic acid

Structure Search

SMILES

C\C=C(\Cl)C(O)=O

InChI

InChIKey=WMDBQMYVAIBBDH-NSCUHMNNSA-N

InChI=1S/C4H5ClO2/c1-2-3(5)4(6)7/h2H,1H3,(H,6,7)/b3-2+

HIDE SMILES / InChI

Molecular Formula	C4H5ClO2
Molecular Weight	120.534
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:16:26 GMT 2025` Edited by `admin` on `Wed Apr 02 12:16:26 GMT 2025`
Record UNII	6V7VW4N5JE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-1188

Preferred Name

English

2-Chlorocrotonic acid

Systematic Name

English

Crotonic acid, 2-chloro-

Systematic Name

English

2-Chloro-2-butenoic acid

Systematic Name

English

2-Butenoic acid, 2-chloro-

Systematic Name

English

Code System Code Type Description

PUBCHEM

5354132

Created by admin on Wed Apr 02 12:16:26 GMT 2025 , Edited by admin on Wed Apr 02 12:16:26 GMT 2025

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EPA CompTox

DTXSID701032045

Created by admin on Wed Apr 02 12:16:26 GMT 2025 , Edited by admin on Wed Apr 02 12:16:26 GMT 2025

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FDA UNII

6V7VW4N5JE

Created by admin on Wed Apr 02 12:16:26 GMT 2025 , Edited by admin on Wed Apr 02 12:16:26 GMT 2025

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NSC

1188

Created by admin on Wed Apr 02 12:16:26 GMT 2025 , Edited by admin on Wed Apr 02 12:16:26 GMT 2025

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CAS

600-13-5

Created by admin on Wed Apr 02 12:16:26 GMT 2025 , Edited by admin on Wed Apr 02 12:16:26 GMT 2025

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