METHYL 3-ACETOXY-2-METHYLBUTYRATE, (2R,3S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C8H14O4
Molecular Weight	174.1944
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of METHYL 3-ACETOXY-2-METHYLBUTYRATE, (2R,3S)-

Structure Search

SMILES

COC(=O)[C@H](C)[C@H](C)OC(C)=O

InChI

InChIKey=UYUNIPJXXCRQBO-RITPCOANSA-N

InChI=1S/C8H14O4/c1-5(8(10)11-4)6(2)12-7(3)9/h5-6H,1-4H3/t5-,6+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C8H14O4
Molecular Weight	174.1944
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:39:30 GMT 2025` Edited by `admin` on `Mon Mar 31 20:39:30 GMT 2025`
Record UNII	533CJX72JV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

FEMA NO. 4451, (2R,3S)-

Preferred Name

English

METHYL 3-ACETOXY-2-METHYLBUTYRATE, (2R,3S)-

Systematic Name

English

METHYL 3-ACETOXY-2-METHYL-BUTANOATE, (2R,3S)-

Systematic Name

English

METHYL (2R,3S)-3-ACETOXY-2-METHYL-BUTANOATE

Systematic Name

English

BUTANOIC ACID, 3-(ACETYLOXY)-2-METHYL-, METHYL ESTER, (S-(R*,S*))-

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID80229136

Created by admin on Mon Mar 31 20:39:30 GMT 2025 , Edited by admin on Mon Mar 31 20:39:30 GMT 2025

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PUBCHEM

71587287

Created by admin on Mon Mar 31 20:39:30 GMT 2025 , Edited by admin on Mon Mar 31 20:39:30 GMT 2025

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CAS

78522-80-2

Created by admin on Mon Mar 31 20:39:30 GMT 2025 , Edited by admin on Mon Mar 31 20:39:30 GMT 2025

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FDA UNII

533CJX72JV

Created by admin on Mon Mar 31 20:39:30 GMT 2025 , Edited by admin on Mon Mar 31 20:39:30 GMT 2025

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