3-Amino-2,5-dimethylbenzoic acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H11NO2
Molecular Weight	165.1891
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Amino-2,5-dimethylbenzoic acid

Structure Search

SMILES

CC1=CC(C(O)=O)=C(C)C(N)=C1

InChI

InChIKey=CYETZFOMNAFWSY-UHFFFAOYSA-N

InChI=1S/C9H11NO2/c1-5-3-7(9(11)12)6(2)8(10)4-5/h3-4H,10H2,1-2H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C9H11NO2
Molecular Weight	165.1891
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 `Wed Apr 02 12:19:06 GMT 2025` Edited by `admin` on `Wed Apr 02 12:19:06 GMT 2025`
Record UNII	Y26EHD5LUY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Amino-2,5-dimethylbenzoic acid

Systematic Name

English

NSC-82831

Preferred Name

English

Benzoic acid, 3-amino-2,5-dimethyl-

Systematic Name

English

2,5-Dimethyl-3-amino-benzoic acid

Systematic Name

English

Code System Code Type Description

CAS

60772-68-1

Created by admin on Wed Apr 02 12:19:06 GMT 2025 , Edited by admin on Wed Apr 02 12:19:06 GMT 2025

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PUBCHEM

43471

Created by admin on Wed Apr 02 12:19:06 GMT 2025 , Edited by admin on Wed Apr 02 12:19:06 GMT 2025

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FDA UNII

Y26EHD5LUY

Created by admin on Wed Apr 02 12:19:06 GMT 2025 , Edited by admin on Wed Apr 02 12:19:06 GMT 2025

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NSC

82831

Created by admin on Wed Apr 02 12:19:06 GMT 2025 , Edited by admin on Wed Apr 02 12:19:06 GMT 2025

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EPA CompTox

DTXSID00209596

Created by admin on Wed Apr 02 12:19:06 GMT 2025 , Edited by admin on Wed Apr 02 12:19:06 GMT 2025

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