ETHYL .ALPHA.-BROMOBUTYRATE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C6H11BrO2
Molecular Weight	195.054
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL .ALPHA.-BROMOBUTYRATE

Structure Search

SMILES

CCOC(=O)C(Br)CC

InChI

InChIKey=XIMFCGSNSKXPBO-UHFFFAOYSA-N

InChI=1S/C6H11BrO2/c1-3-5(7)6(8)9-4-2/h5H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C6H11BrO2
Molecular Weight	195.054
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:30:54 GMT 2025` Edited by `admin` on `Mon Mar 31 23:30:54 GMT 2025`
Record UNII	SB2GD08LJA
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-8855

Preferred Name

English

ETHYL .ALPHA.-BROMOBUTYRATE

Systematic Name

English

ETHYL 2-BROMOBUTANOATE

Systematic Name

English

2-BROMOBUTYRIC ACID ETHYL ESTER

Systematic Name

English

ETHYL .ALPHA.-BROMOBUTYRATE, (±)-

Systematic Name

English

BUTANOIC ACID, 2-BROMO-, ETHYL ESTER

Systematic Name

English

ETHYL 2-BROMOBUTYRATE

Systematic Name

English

.ALPHA.-BROMOBUTYRIC ACID ETHYL ESTER [MI]

Common Name

English

Code System Code Type Description

CAS

533-68-6

Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025

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PUBCHEM

79039

Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025

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FDA UNII

SB2GD08LJA

Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025

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NSC

8855

Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025

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MERCK INDEX

m2690

Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025

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Merck Index

EPA CompTox

DTXSID30870591

Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025

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ECHA (EC/EINECS)

208-574-6

Created by admin on Mon Mar 31 23:30:54 GMT 2025 , Edited by admin on Mon Mar 31 23:30:54 GMT 2025

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