2,3,5,6-Tetramethylbenzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C11H14O2
Molecular Weight	178.2277
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,3,5,6-Tetramethylbenzoic acid

Structure Search

SMILES

CC1=CC(C)=C(C)C(C(O)=O)=C1C

InChI

InChIKey=STIDRZRESMTQBD-UHFFFAOYSA-N

InChI=1S/C11H14O2/c1-6-5-7(2)9(4)10(8(6)3)11(12)13/h5H,1-4H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula	C11H14O2
Molecular Weight	178.2277
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 19:22:04 GMT 2025` Edited by `admin` on `Tue Apr 01 19:22:04 GMT 2025`
Record UNII	UTY2MW5SWY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-409541

Preferred Name

English

2,3,5,6-Tetramethylbenzoic acid

Common Name

English

BENZOIC ACID, 2,3,5,6-TETRAMETHYL-

Common Name

English

Code System Code Type Description

NSC

409541

Created by admin on Tue Apr 01 19:22:04 GMT 2025 , Edited by admin on Tue Apr 01 19:22:04 GMT 2025

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PUBCHEM

17452

Created by admin on Tue Apr 01 19:22:04 GMT 2025 , Edited by admin on Tue Apr 01 19:22:04 GMT 2025

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FDA UNII

UTY2MW5SWY

Created by admin on Tue Apr 01 19:22:04 GMT 2025 , Edited by admin on Tue Apr 01 19:22:04 GMT 2025

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EPA CompTox

DTXSID30180687

Created by admin on Tue Apr 01 19:22:04 GMT 2025 , Edited by admin on Tue Apr 01 19:22:04 GMT 2025

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CAS

2604-45-7

Created by admin on Tue Apr 01 19:22:04 GMT 2025 , Edited by admin on Tue Apr 01 19:22:04 GMT 2025

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ECHA (EC/EINECS)

220-015-8

Created by admin on Tue Apr 01 19:22:04 GMT 2025 , Edited by admin on Tue Apr 01 19:22:04 GMT 2025

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