2-Ncs-dizocilpine

Base Information

• Chemical Name: 2-Ncs-dizocilpine
• CAS No.: 149715-73-1
• Molecular Formula: C17H14 N2 S
• Molecular Weight: 278.37
• DSSTox Substance ID: DTXSID30933711
• Mol file: 149715-73-1.mol

Synonyms:2-isothiocyanato-5-methyl-10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5,10-imine;2-NCS-dizocilpine;MK-801 2-isothiocyanate

Chemical Property of 2-Ncs-dizocilpine

Chemical Property:

• Vapor Pressure: 3.95E-07mmHg at 25°C
• Boiling Point: 416°Cat760mmHg
• Flash Point: 205.4°C
• PSA: 56.48000
• Density: 1.29g/cm³
• LogP: 4.21360
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 278.08776963
• Heavy Atom Count: 20
• Complexity: 444

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12C3=C(CC(N1)C4=CC=CC=C24)C=C(C=C3)N=C=S