ETHYL 6-CHLORO-6-OXOHEXANOATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H13ClO3
Molecular Weight	192.64
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL 6-CHLORO-6-OXOHEXANOATE

Structure Search

SMILES

CCOC(=O)CCCCC(Cl)=O

InChI

InChIKey=VEOZBFFLKPBVIY-UHFFFAOYSA-N

InChI=1S/C8H13ClO3/c1-2-12-8(11)6-4-3-5-7(9)10/h2-6H2,1H3

HIDE SMILES / InChI

Molecular Formula	C8H13ClO3
Molecular Weight	192.64
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 19:25:20 GMT 2025` Edited by `admin` on `Tue Apr 01 19:25:20 GMT 2025`
Record UNII	P7RYK2R5AD
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ETHYL 6-CHLORO-6-OXOHEXANOATE

Systematic Name

English

HEXANOIC ACID, 6-CHLORO-6-OXO-, ETHYL ESTER

Preferred Name

English

6-CHLORO-6-OXO-HEXANOIC ACID, ETHYL ESTER

Common Name

English

Code System Code Type Description

PUBCHEM

14065

Created by admin on Tue Apr 01 19:25:20 GMT 2025 , Edited by admin on Tue Apr 01 19:25:20 GMT 2025

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FDA UNII

P7RYK2R5AD

Created by admin on Tue Apr 01 19:25:20 GMT 2025 , Edited by admin on Tue Apr 01 19:25:20 GMT 2025

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CAS

1071-71-2

Created by admin on Tue Apr 01 19:25:20 GMT 2025 , Edited by admin on Tue Apr 01 19:25:20 GMT 2025

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ECHA (EC/EINECS)

213-993-2

Created by admin on Tue Apr 01 19:25:20 GMT 2025 , Edited by admin on Tue Apr 01 19:25:20 GMT 2025

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EPA CompTox

DTXSID70147916

Created by admin on Tue Apr 01 19:25:20 GMT 2025 , Edited by admin on Tue Apr 01 19:25:20 GMT 2025

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