2-ISOPROPYL CITRATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H14O7
Molecular Weight	234.2033
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-ISOPROPYL CITRATE

Structure Search

SMILES

CC(C)OC(=O)C(O)(CC(O)=O)CC(O)=O

InChI

InChIKey=VRBUFFFVTDWWMY-UHFFFAOYSA-N

InChI=1S/C9H14O7/c1-5(2)16-8(14)9(15,3-6(10)11)4-7(12)13/h5,15H,3-4H2,1-2H3,(H,10,11)(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C9H14O7
Molecular Weight	234.2033
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 `Mon Mar 31 22:10:34 GMT 2025` Edited by `admin` on `Mon Mar 31 22:10:34 GMT 2025`
Record UNII	GR0934P0DP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-ISOPROPYL CITRATE

Common Name

English

1,2,3-PROPANETRICARBOXYLIC ACID, 2-HYDROXY-, 2-(1-METHYLETHYL) ESTER

Preferred Name

English

2-ISOPROPYL DIHYDROGEN CITRATE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID00274148

Created by admin on Mon Mar 31 22:10:34 GMT 2025 , Edited by admin on Mon Mar 31 22:10:34 GMT 2025

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ECHA (EC/EINECS)

281-490-5

Created by admin on Mon Mar 31 22:10:34 GMT 2025 , Edited by admin on Mon Mar 31 22:10:34 GMT 2025

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PUBCHEM

57483158

Created by admin on Mon Mar 31 22:10:34 GMT 2025 , Edited by admin on Mon Mar 31 22:10:34 GMT 2025

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FDA UNII

GR0934P0DP

Created by admin on Mon Mar 31 22:10:34 GMT 2025 , Edited by admin on Mon Mar 31 22:10:34 GMT 2025

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CAS

83966-24-9

Created by admin on Mon Mar 31 22:10:34 GMT 2025 , Edited by admin on Mon Mar 31 22:10:34 GMT 2025

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