5,7-DIMETHYL-3-INDOLEACETIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H13NO2
Molecular Weight	203.2371
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5,7-DIMETHYL-3-INDOLEACETIC ACID

Structure Search

SMILES

CC1=CC2=C(NC=C2CC(O)=O)C(C)=C1

InChI

InChIKey=XJCBMZMISBSKFP-UHFFFAOYSA-N

InChI=1S/C12H13NO2/c1-7-3-8(2)12-10(4-7)9(6-13-12)5-11(14)15/h3-4,6,13H,5H2,1-2H3,(H,14,15)

HIDE SMILES / InChI

Molecular Formula	C12H13NO2
Molecular Weight	203.2371
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 19:45:05 GMT 2025` Edited by `admin` on `Tue Apr 01 19:45:05 GMT 2025`
Record UNII	3345D2HUV0
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5,7-DIMETHYL-3-INDOLEACETIC ACID

Systematic Name

English

NSC-22867

Preferred Name

English

3-INDOLEACETIC ACID, 5,7-DIMETHYL-

Systematic Name

English

INDOLE-3-ACETIC ACID, 5,7-DIMETHYL-

Systematic Name

English

1H-INDOLE-3-ACETIC ACID, 5,7-DIMETHYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60224907

Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025

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CAS

74038-94-1

Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025

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NSC

22867

Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025

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PUBCHEM

52897

Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025

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FDA UNII

3345D2HUV0

Created by admin on Tue Apr 01 19:45:05 GMT 2025 , Edited by admin on Tue Apr 01 19:45:05 GMT 2025

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