N-(2-Chloroethyl)-N-Nitrosocarbamoylvalinamide
[CAS# 81965-44-8]

Identification

• Name: N-(2-Chloroethyl)-N-Nitrosocarbamoylvalinamide
• Synonyms: (2S)-N-(2-Chloroethyl)-N-Nitroso-Pyrrolidine-1,2-Dicarboxamide; (S)-N(Sup 1)-(2-Chloroethyl)-N(Sup 1)-Nitroso-1,2-Pyrrolidinedicarboxamide; 1,2-Pyrrolidinedicarboxamide, N(Sup 1)-(2-Chloroethyl)-N(Sup 1)-Nitroso-, (S)-
• Molecular Formula: C₈H₁₃ClN₄O₃
• Molecular Weight: 248.67
• CAS Registry Number: 81965-44-8
• SMILES: [C@@H]1(N(CCC1)C(=O)N(N=O)CCCl)C(=O)N
• InChI: 1S/C8H13ClN4O3/c9-3-5-13(11-16)8(15)12-4-1-2-6(12)7(10)14/h6H,1-5H2,(H2,10,14)/t6-/m0/s1
• InChIKey: ZOBZYPPNZPDEHJ-LURJTMIESA-N

Properties

• Density: 1.582g/cm³ (Cal.)
• Boiling point: 441.795°C at 760 mmHg (Cal.)
• Flash point: 220.99°C (Cal.)