5-CHLORO-1,2-DIHYDRO-1-ISOPROPYL-3H-1,2,4-TRIAZOL-3-ONE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H8ClN3O
Molecular Weight	161.59
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-CHLORO-1,2-DIHYDRO-1-ISOPROPYL-3H-1,2,4-TRIAZOL-3-ONE

Structure Search

SMILES

CC(C)N1NC(=O)N=C1Cl

InChI

InChIKey=ZPVFNVKXPPDEOU-UHFFFAOYSA-N

InChI=1S/C5H8ClN3O/c1-3(2)9-4(6)7-5(10)8-9/h3H,1-2H3,(H,8,10)

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

Title	Date	PubMed
Pesticide urinary metabolite levels of children in eastern North Carolina farmworker households.	2007-08	17687456

Patents

Patents

Name

Type

Language

1-ISOPROPYL-3-HYDROXY-5-CHLORO-1,2,4-TRIAZOLE

Preferred Name

English

5-CHLORO-1,2-DIHYDRO-1-ISOPROPYL-3H-1,2,4-TRIAZOL-3-ONE

Systematic Name

English

5-CHLORO-3-HYDROXY-1-ISOPROPYL-1,2,4-TRIAZOLE

Systematic Name

English

3H-1,2,4-TRIAZOL-3-ONE, 5-CHLORO-1,2-DIHYDRO-1-(1-METHYLETHYL)-

Systematic Name

English

1-ISOPROPYL-5-CHLORO-3-HYDROXY-1,2,4-TRIAZOLE

Systematic Name

English

Code System Code Type Description

CAS

42509-62-6

Created by admin on Mon Mar 31 19:04:16 GMT 2025 , Edited by admin on Mon Mar 31 19:04:16 GMT 2025

PRIMARY

ECHA (EC/EINECS)

255-862-2

Created by admin on Mon Mar 31 19:04:16 GMT 2025 , Edited by admin on Mon Mar 31 19:04:16 GMT 2025

PRIMARY

EPA CompTox

DTXSID2052863

Created by admin on Mon Mar 31 19:04:16 GMT 2025 , Edited by admin on Mon Mar 31 19:04:16 GMT 2025

PRIMARY

PUBCHEM

170660

Created by admin on Mon Mar 31 19:04:16 GMT 2025 , Edited by admin on Mon Mar 31 19:04:16 GMT 2025

PRIMARY

FDA UNII

3O7BN60A5H

Created by admin on Mon Mar 31 19:04:16 GMT 2025 , Edited by admin on Mon Mar 31 19:04:16 GMT 2025

PRIMARY

SUBSTANCE RECORD


					3O7BN60A5H

5-CHLORO-1,2-DIHYDRO-1-ISOPROPYL-3H-1,2,4-TRIAZOL-3-ONE