1-Benzylbiguanide hydrochloride

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H13N5.ClH
Molecular Weight	227.694
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-Benzylbiguanide hydrochloride

Structure Search

SMILES

Cl.NC(=N)NC(=N)NCC1=CC=CC=C1

InChI

InChIKey=AQJYNUYNAIBZPG-UHFFFAOYSA-N

InChI=1S/C9H13N5.ClH/c10-8(11)14-9(12)13-6-7-4-2-1-3-5-7;/h1-5H,6H2,(H6,10,11,12,13,14);1H

HIDE SMILES / InChI

Molecular Formula	C9H13N5
Molecular Weight	191.233
Charge	0
Count

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

Molecular Formula	ClH
Molecular Weight	36.461
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 19:50:55 GMT 2025` Edited by `admin` on `Tue Apr 01 19:50:55 GMT 2025`
Record UNII	CMU7H75QDV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-20590

Preferred Name

English

1-Benzylbiguanide hydrochloride

Common Name

English

Imidodicarbonimidic diamide, N-(phenylmethyl)-, hydrochloride

Systematic Name

English

Biguanide, 1-benzyl-, monohydrochloride

Common Name

English

Code System Code Type Description

FDA UNII

CMU7H75QDV

Created by admin on Tue Apr 01 19:50:55 GMT 2025 , Edited by admin on Tue Apr 01 19:50:55 GMT 2025

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NSC

20590

Created by admin on Tue Apr 01 19:50:55 GMT 2025 , Edited by admin on Tue Apr 01 19:50:55 GMT 2025

PRIMARY

PUBCHEM

11148873

Created by admin on Tue Apr 01 19:50:55 GMT 2025 , Edited by admin on Tue Apr 01 19:50:55 GMT 2025

PRIMARY

EPA CompTox

DTXSID801350272

Created by admin on Tue Apr 01 19:50:55 GMT 2025 , Edited by admin on Tue Apr 01 19:50:55 GMT 2025

PRIMARY

CAS

1421-23-4

Created by admin on Tue Apr 01 19:50:55 GMT 2025 , Edited by admin on Tue Apr 01 19:50:55 GMT 2025

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Related Record Type Details


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1-Benzylbiguanide

PARENT -> SALT/SOLVATE

Amount: