1-[(2-Chlorophenyl)(methylimino)methyl]cyclopentan-1-ol

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H16ClNO
Molecular Weight	237.725
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of 1-[(2-Chlorophenyl)(methylimino)methyl]cyclopentan-1-ol

Structure Search

SMILES

CN=C(C1=CC=CC=C1Cl)C2(O)CCCC2

InChI

InChIKey=FJGPXUPMNZOTLX-NTCAYCPXSA-N

InChI=1S/C13H16ClNO/c1-15-12(13(16)8-4-5-9-13)10-6-2-3-7-11(10)14/h2-3,6-7,16H,4-5,8-9H2,1H3/b15-12+

HIDE SMILES / InChI

Molecular Formula	C13H16ClNO
Molecular Weight	237.725
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:53:08 UTC 2023` Edited by `admin` on `Sat Dec 16 10:53:08 UTC 2023`
Record UNII	HGI99H315N
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1-[(2-Chlorophenyl)(methylimino)methyl]cyclopentan-1-ol

Systematic Name

English

KETAMINE RELATED COMPOUND A [USP-RS]

Common Name

English

KETAMINE RELATED COMPOUND A

Common Name

English

CYCLOPENTANOL, 1-((2-CHLOROPHENYL)(METHYLIMINO)METHYL)-

Systematic Name

English

Ketamine hydroxylimine precursor

Common Name

English

KETAMINE HYDROCHLORIDE IMPURITY A [EP IMPURITY]

Common Name

English

ESKETAMINE HYDROCHLORIDE IMPURITY A [EP IMPURITY]

Common Name

English

1-(2-CHLORO-N-METHYLBENZIMIDOYL)CYCLOPENTANOL

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60217758

Created by admin on Sat Dec 16 10:53:08 UTC 2023 , Edited by admin on Sat Dec 16 10:53:08 UTC 2023

PRIMARY

FDA UNII

HGI99H315N

Created by admin on Sat Dec 16 10:53:08 UTC 2023 , Edited by admin on Sat Dec 16 10:53:08 UTC 2023

PRIMARY

CAS

6740-87-0

Created by admin on Sat Dec 16 10:53:08 UTC 2023 , Edited by admin on Sat Dec 16 10:53:08 UTC 2023

PRIMARY

RS_ITEM_NUM

1356020

Created by admin on Sat Dec 16 10:53:08 UTC 2023 , Edited by admin on Sat Dec 16 10:53:08 UTC 2023

PRIMARY

PUBCHEM

13086940

Created by admin on Sat Dec 16 10:53:08 UTC 2023 , Edited by admin on Sat Dec 16 10:53:08 UTC 2023

PRIMARY

Related Record Type Details


					690G0D6V8H

KETAMINE

PARENT->PRECURSOR

Amount:


					Q666C84J7M

1-[(2-Chlorophenyl)(methylimino)methyl]cyclopentan-1-ol hydrochloride

SALT/SOLVATE -> PARENT

Amount:

Related Record Type Details


					O18YUO0I83

KETAMINE HYDROCHLORIDE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: