3A,4,5,6,7,8-HEXAHYDROCYCLOHEPTA(C)PYRAZOL-3(2H)-ONE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H12N2O
Molecular Weight	152.1937
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3A,4,5,6,7,8-HEXAHYDROCYCLOHEPTA(C)PYRAZOL-3(2H)-ONE

Structure Search

SMILES

OC1=C2CCCCCC2=NN1

InChI

InChIKey=QXVHMLFNQLFORJ-UHFFFAOYSA-N

InChI=1S/C8H12N2O/c11-8-6-4-2-1-3-5-7(6)9-10-8/h1-5H2,(H2,9,10,11)

HIDE SMILES / InChI

Molecular Formula	C8H12N2O
Molecular Weight	152.1937
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 `Sat Dec 16 12:39:59 GMT 2023` Edited by `admin` on `Sat Dec 16 12:39:59 GMT 2023`
Record UNII	9FT8XY82UO
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3A,4,5,6,7,8-HEXAHYDROCYCLOHEPTA(C)PYRAZOL-3(2H)-ONE

Common Name

English

NSC-131090

Code

English

3-CYCLOHEPTAPYRAZOLOL, 2,4,5,6,7,8-HEXAHYDRO-

Systematic Name

English

Code System Code Type Description

PUBCHEM

12034715

Created by admin on Sat Dec 16 12:39:59 GMT 2023 , Edited by admin on Sat Dec 16 12:39:59 GMT 2023

PRIMARY

FDA UNII

9FT8XY82UO

Created by admin on Sat Dec 16 12:39:59 GMT 2023 , Edited by admin on Sat Dec 16 12:39:59 GMT 2023

PRIMARY

CAS

117891-68-6

Created by admin on Sat Dec 16 12:39:59 GMT 2023 , Edited by admin on Sat Dec 16 12:39:59 GMT 2023

ALTERNATIVE

CAS

19462-61-4

Created by admin on Sat Dec 16 12:39:59 GMT 2023 , Edited by admin on Sat Dec 16 12:39:59 GMT 2023

PRIMARY

NSC

131090

Created by admin on Sat Dec 16 12:39:59 GMT 2023 , Edited by admin on Sat Dec 16 12:39:59 GMT 2023

PRIMARY