4-[Bis(2-chloroethyl)amino]phenyl thiocyanate
[CAS# 86098-92-2]

Identification

• Name: 4-[Bis(2-chloroethyl)amino]phenyl thiocyanate
• Synonyms: 4-[bis(2-chloroethyl)amino]phenyl thiocyanate; NSC63023
• Molecular Formula: C₁₁H₁₂Cl₂N₂S
• Molecular Weight: 275.20
• CAS Registry Number: 86098-92-2
• SMILES: N#CSc1ccc(cc1)N(CCCl)CCCl
• InChI: 1S/C11H12Cl2N2S/c12-5-7-15(8-6-13)10-1-3-11(4-2-10)16-9-14/h1-4H,5-8H2
• InChIKey: XTOTUADJOUZGGV-UHFFFAOYSA-N

Properties

• Density: 1.315g/cm³ (Cal.)
• Boiling point: 415.322°C at 760 mmHg (Cal.)
• Flash point: 204.979°C (Cal.)