7-Chloro-3-methyl-4-(3-methyl-but-2-enyl)-1,3,4,5-tetrahydro-1,4-benzodiazepine-2-thione

Base Information

• Chemical Name: 7-Chloro-3-methyl-4-(3-methyl-but-2-enyl)-1,3,4,5-tetrahydro-1,4-benzodiazepine-2-thione
• CAS No.: 258849-86-4
• Molecular Formula: C15H19 Cl N2 S
• Molecular Weight: 294.8428
• DSSTox Substance ID: DTXSID20948773
• Mol file: 258849-86-4.mol

Synonyms:258849-86-4;7-Chloro-3-methyl-4-(3-methyl-but-2-enyl)-1,3,4,5-tetrahydro-1,4-benzodiazepine-2-thione;2H-1,4-Benzodiazepine-2-thione, 7-chloro-1,3,4,5-tetrahydro-3-methyl-4-(3-methyl-2-butenyl)-;DTXSID20948773;7-chloro-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-1H-1,4-benzodiazepine-2-thione;7-Chloro-3-methyl-4-(3-methylbut-2-en-1-yl)-1,3,4,5-tetrahydro-2H-1,4-benzodiazepine-2-thione

Chemical Property of 7-Chloro-3-methyl-4-(3-methyl-but-2-enyl)-1,3,4,5-tetrahydro-1,4-benzodiazepine-2-thione

Chemical Property:

• Vapor Pressure: 4.2E-06mmHg at 25°C
• Boiling Point: 384.1°Cat760mmHg
• Flash Point: 186.1°C
• Density: 1.21g/cm³
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 294.0957475
• Heavy Atom Count: 19
• Complexity: 365

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1C(=S)NC2=C(CN1CC=C(C)C)C=C(C=C2)Cl

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