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Details

Stereochemistry ACHIRAL
Molecular Formula C8H10ClN5
Molecular Weight 211.652
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4-CHLOROPHENYL)BIGUANIDE

SMILES

NC(=N)NC(=N)NC1=CC=C(Cl)C=C1

InChI

InChIKey=HTYFFCPFVMJTKM-UHFFFAOYSA-N
InChI=1S/C8H10ClN5/c9-5-1-3-6(4-2-5)13-8(12)14-7(10)11/h1-4H,(H6,10,11,12,13,14)

HIDE SMILES / InChI

Molecular Formula C8H10ClN5
Molecular Weight 211.652
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 10:49:56 UTC 2023
Edited
by admin
on Sat Dec 16 10:49:56 UTC 2023
Record UNII
61UQ98597T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4-CHLOROPHENYL)BIGUANIDE
Systematic Name English
IMIDODICARBONIMIDIC DIAMIDE, N-(4-CHLOROPHENYL)-
Systematic Name English
NSC-220325
Code English
(P-CHLOROPHENYL)BIGUANIDE
Common Name English
1-(4-CHLOROPHENYL)BIGUANIDE
Systematic Name English
N1-(P-CHLOROPHENYL)BIGUANIDE
Common Name English
4-CHLOROPHENYLBIGUANIDE
Systematic Name English
1-(P-CHLOROPHENYL)DIGUANIDE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID10201086
Created by admin on Sat Dec 16 10:49:56 UTC 2023 , Edited by admin on Sat Dec 16 10:49:56 UTC 2023
PRIMARY
CAS
5304-59-6
Created by admin on Sat Dec 16 10:49:56 UTC 2023 , Edited by admin on Sat Dec 16 10:49:56 UTC 2023
PRIMARY
FDA UNII
61UQ98597T
Created by admin on Sat Dec 16 10:49:56 UTC 2023 , Edited by admin on Sat Dec 16 10:49:56 UTC 2023
PRIMARY
NSC
220325
Created by admin on Sat Dec 16 10:49:56 UTC 2023 , Edited by admin on Sat Dec 16 10:49:56 UTC 2023
PRIMARY
ECHA (EC/EINECS)
226-155-6
Created by admin on Sat Dec 16 10:49:56 UTC 2023 , Edited by admin on Sat Dec 16 10:49:56 UTC 2023
PRIMARY
PUBCHEM
19933
Created by admin on Sat Dec 16 10:49:56 UTC 2023 , Edited by admin on Sat Dec 16 10:49:56 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE
MAJOR
PLASMA