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Details

Stereochemistry ACHIRAL
Molecular Formula C11H11ClN2.ClH
Molecular Weight 243.132
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-Chloro-2,4-dimethyl-3H-1,5-benzodiazepine hydrochloride

SMILES

Cl.CC1=NC2=C(C=C(Cl)C=C2)N=C(C)C1

InChI

InChIKey=YZXJCSPKZAAQQC-UHFFFAOYSA-N
InChI=1S/C11H11ClN2.ClH/c1-7-5-8(2)14-11-6-9(12)3-4-10(11)13-7;/h3-4,6H,5H2,1-2H3;1H

HIDE SMILES / InChI

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

Molecular Formula C11H11ClN2
Molecular Weight 206.671
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 Wed Apr 02 14:41:46 GMT 2025
Edited
by admin
on Wed Apr 02 14:41:46 GMT 2025
Record UNII
F6XWN82ZFP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3H-1,5-Benzodiazepine, 7-chloro-2,4-dimethyl-, hydrochloride (1:1)
Preferred Name English
7-Chloro-2,4-dimethyl-3H-1,5-benzodiazepine hydrochloride
Systematic Name English
3H-1,5-Benzodiazepine, 7-chloro-2,4-dimethyl-, monohydrochloride
Systematic Name English
7-chloro-2,4-dimethyl-3H-benzo[b][1,4]diazepine hydrochloride
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70188622
Created by admin on Wed Apr 02 14:41:46 GMT 2025 , Edited by admin on Wed Apr 02 14:41:46 GMT 2025
PRIMARY
CAS
3512-91-2
Created by admin on Wed Apr 02 14:41:46 GMT 2025 , Edited by admin on Wed Apr 02 14:41:46 GMT 2025
PRIMARY
PUBCHEM
24197721
Created by admin on Wed Apr 02 14:41:46 GMT 2025 , Edited by admin on Wed Apr 02 14:41:46 GMT 2025
PRIMARY
FDA UNII
F6XWN82ZFP
Created by admin on Wed Apr 02 14:41:46 GMT 2025 , Edited by admin on Wed Apr 02 14:41:46 GMT 2025
PRIMARY
NSC
270340
Created by admin on Wed Apr 02 14:41:46 GMT 2025 , Edited by admin on Wed Apr 02 14:41:46 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE