N-[Bis(2-Chloroethyl)Aminomethyl]Carbamic Acid Phenyl Ester
[CAS# 58050-47-8]

Identification

• Name: N-[Bis(2-Chloroethyl)Aminomethyl]Carbamic Acid Phenyl Ester
• Synonyms: N-[Bis(2-Chloroethyl)Aminomethyl]Carbamic Acid Phenyl Ester; Carbamic Acid, N-Bis(2-Chloroethyl)Aminomethyl-, Phenyl Ester; N-(Bis-(2-Chloraethyl)Aminomethyl)Phenylurethan [German]
• Molecular Formula: C₁₂H₁₆Cl₂N₂O₂
• Molecular Weight: 291.18
• CAS Registry Number: 58050-47-8
• SMILES: C1=CC=CC=C1OC(NCN(CCCl)CCCl)=O
• InChI: 1S/C12H16Cl2N2O2/c13-6-8-16(9-7-14)10-15-12(17)18-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,15,17)
• InChIKey: KWFCOVFVHYDAFG-UHFFFAOYSA-N

Properties

• Density: 1.255g/cm³ (Cal.)
• Boiling point: 326.315°C at 760 mmHg (Cal.)
• Flash point: 151.15°C (Cal.)