3-[Bis(2-Chloroethyl)Aminomethyl]Benzooxazol-2-One
[CAS# 7751-31-7]

Identification

• Name: 3-[Bis(2-Chloroethyl)Aminomethyl]Benzooxazol-2-One
• Synonyms: 2-Benzoxazolinone, 3-(Bis(2-Chloroethyl)Aminomethyl)-; 3-(Bis(2-Chloroethyl)Aminomethyl)-2-Benzoxazolinone; 3-(Bis-(2-Chloraethyl)Aminomethyl)Benzoxazolon-(2) [German]
• Molecular Formula: C₁₂H₁₄Cl₂N₂O₂
• Molecular Weight: 289.16
• CAS Registry Number: 7751-31-7
• SMILES: C1=CC=CC2=C1N(CN(CCCl)CCCl)C(O2)=O
• InChI: 1S/C12H14Cl2N2O2/c13-5-7-15(8-6-14)9-16-10-3-1-2-4-11(10)18-12(16)17/h1-4H,5-9H2
• InChIKey: KDKINIHDQKJCMG-UHFFFAOYSA-N

Properties

• Density: 1.35g/cm³ (Cal.)
• Boiling point: 337.979°C at 760 mmHg (Cal.)
• Flash point: 158.205°C (Cal.)