1,3,5-Pentanetricarboxylic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H12O6
Molecular Weight	204.1773
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1,3,5-Pentanetricarboxylic acid

Structure Search

SMILES

OC(=O)CCC(CCC(O)=O)C(O)=O

InChI

InChIKey=ROTJZTYLACIJIG-UHFFFAOYSA-N

InChI=1S/C8H12O6/c9-6(10)3-1-5(8(13)14)2-4-7(11)12/h5H,1-4H2,(H,9,10)(H,11,12)(H,13,14)

HIDE SMILES / InChI

Molecular Formula	C8H12O6
Molecular Weight	204.1773
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 19:35:47 GMT 2025` Edited by `admin` on `Tue Apr 01 19:35:47 GMT 2025`
Record UNII	BER6XSP3DG
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1,3,5-Pentanetricarboxylic acid

Systematic Name

English

Pentane-1,3,5-tricarboxylic acid

Preferred Name

English

NSC-60156

Code

English

Code System Code Type Description

PUBCHEM

96220

Created by admin on Tue Apr 01 19:35:47 GMT 2025 , Edited by admin on Tue Apr 01 19:35:47 GMT 2025

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NSC

60156

Created by admin on Tue Apr 01 19:35:47 GMT 2025 , Edited by admin on Tue Apr 01 19:35:47 GMT 2025

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EPA CompTox

DTXSID50219529

Created by admin on Tue Apr 01 19:35:47 GMT 2025 , Edited by admin on Tue Apr 01 19:35:47 GMT 2025

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FDA UNII

BER6XSP3DG

Created by admin on Tue Apr 01 19:35:47 GMT 2025 , Edited by admin on Tue Apr 01 19:35:47 GMT 2025

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ECHA (EC/EINECS)

230-087-2

Created by admin on Tue Apr 01 19:35:47 GMT 2025 , Edited by admin on Tue Apr 01 19:35:47 GMT 2025

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CAS

6940-58-5

Created by admin on Tue Apr 01 19:35:47 GMT 2025 , Edited by admin on Tue Apr 01 19:35:47 GMT 2025

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