4-(furan-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine

Base Information

• Chemical Name: 4-(furan-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine
• CAS No.: 394655-12-0
• Molecular Formula: C13H12N2O
• Molecular Weight: 212.25
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID90377995
• ChEMBL ID: CHEMBL4948887
• Mol file: 394655-12-0.mol

Synonyms:394655-12-0;4-(furan-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine;4-(2-FURYL)-2,3-DIHYDRO-1H-1,5-BENZODIAZEPINE;2,3-Dihydro-4-(fur-2-yl)-1H-1,5-benzodiazepine;4-(Furan-2-yl)-2,3-dihydro-1H-benzo[b][1,4]diazepine;MFCD06245352;CHEMBL4948887;DTXSID90377995;AKOS005254226;PS-3050;SB61276;(E)-4-(furan-2-yl)-2,3-dihydro-1H-benzo[b][1,4]diazepine

Chemical Property of 4-(furan-2-yl)-2,3-dihydro-1H-1,5-benzodiazepine

Chemical Property:

• Vapor Pressure: 4.14E-05mmHg at 25°C
• Refractive Index: 1.643
• Boiling Point: 351.3 °C at 760 mmHg
• Flash Point: 166.3 °C
• PSA: 37.53000
• Density: 1.23g/cm³
• LogP: 2.78960
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 212.094963011
• Heavy Atom Count: 16
• Complexity: 277

Purity/Quality:

NLT 98% ^*data from raw suppliers

2,3-Dihydro-4-(fur-2-yl)-1H-1,5-benzodiazepine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNC2=CC=CC=C2N=C1C3=CC=CO3