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Details

Stereochemistry ACHIRAL
Molecular Formula C15H14ClN2.Cl
Molecular Weight 293.191
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Chloro-1,2-dimethyl-3-phenyl-1H-benzimidazolium chloride

SMILES

[Cl-].CN1C2=CC=C(Cl)C=C2[N+](=C1C)C3=CC=CC=C3

InChI

InChIKey=VKKYWEDLYZLADD-UHFFFAOYSA-M
InChI=1S/C15H14ClN2.ClH/c1-11-17(2)14-9-8-12(16)10-15(14)18(11)13-6-4-3-5-7-13;/h3-10H,1-2H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C15H14ClN2
Molecular Weight 257.738
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Cl
Molecular Weight 35.453
Charge -1
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 18:09:55 UTC 2023
Edited
by admin
on Sat Dec 16 18:09:55 UTC 2023
Record UNII
7Z9CP53KX5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Chloro-1,2-dimethyl-3-phenyl-1H-benzimidazolium chloride
Systematic Name English
1H-Benzimidazolium, 5-chloro-1,2-dimethyl-3-phenyl-, chloride (1:1)
Systematic Name English
1H-Benzimidazolium, 5-chloro-1,2-dimethyl-3-phenyl-, chloride
Systematic Name English
Code System Code Type Description
FDA UNII
7Z9CP53KX5
Created by admin on Sat Dec 16 18:09:55 UTC 2023 , Edited by admin on Sat Dec 16 18:09:55 UTC 2023
PRIMARY
CAS
75524-10-6
Created by admin on Sat Dec 16 18:09:55 UTC 2023 , Edited by admin on Sat Dec 16 18:09:55 UTC 2023
PRIMARY
PUBCHEM
91984031
Created by admin on Sat Dec 16 18:09:55 UTC 2023 , Edited by admin on Sat Dec 16 18:09:55 UTC 2023
PRIMARY
EPA CompTox
DTXSID10822917
Created by admin on Sat Dec 16 18:09:55 UTC 2023 , Edited by admin on Sat Dec 16 18:09:55 UTC 2023
PRIMARY
Related Record Type Details
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