2,5-DIMETHYL-1H-INDOLE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H11N
Molecular Weight	145.201
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,5-DIMETHYL-1H-INDOLE

Structure Search

SMILES

CC1=CC2=C(N1)C=CC(C)=C2

InChI

InChIKey=ZFLFWZRPMDXJCW-UHFFFAOYSA-N

InChI=1S/C10H11N/c1-7-3-4-10-9(5-7)6-8(2)11-10/h3-6,11H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C10H11N
Molecular Weight	145.201
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

PubMed

Title	Date	PubMed
Indole ring oxidation by activated leukocytes prevents the production of hypochlorous acid.	2005-11	16258625
Prediction of genotoxicity of chemical compounds by statistical learning methods.	2005-06	15962942

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:01:26 GMT 2025` Edited by `admin` on `Mon Mar 31 19:01:26 GMT 2025`
Record UNII	ETU94V283M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,5-DIMETHYL-1H-INDOLE

Preferred Name

English

Code System Code Type Description

ECHA (EC/EINECS)

214-816-1

Created by admin on Mon Mar 31 19:01:26 GMT 2025 , Edited by admin on Mon Mar 31 19:01:26 GMT 2025

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CAS

1196-79-8

Created by admin on Mon Mar 31 19:01:26 GMT 2025 , Edited by admin on Mon Mar 31 19:01:26 GMT 2025

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PUBCHEM

70965

Created by admin on Mon Mar 31 19:01:26 GMT 2025 , Edited by admin on Mon Mar 31 19:01:26 GMT 2025

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EPA CompTox

DTXSID30152521

Created by admin on Mon Mar 31 19:01:26 GMT 2025 , Edited by admin on Mon Mar 31 19:01:26 GMT 2025

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FDA UNII

ETU94V283M

Created by admin on Mon Mar 31 19:01:26 GMT 2025 , Edited by admin on Mon Mar 31 19:01:26 GMT 2025

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