7-Amino-3-Benzyloxycarbonylamino-1-Chloroheptan-2-One
[CAS# 99461-73-1]

Identification

• Name: 7-Amino-3-Benzyloxycarbonylamino-1-Chloroheptan-2-One
• Synonyms: Phenylmethyl N-[5-Amino-1-(2-Chloroacetyl)Pentyl]Carbamate; N-[5-Amino-1-(2-Chloro-1-Oxoethyl)Pentyl]Carbamic Acid Phenylmethyl Ester; N-[5-Amino-1-(2-Chloroacetyl)Pentyl]Carbamic Acid Benzyl Ester
• Molecular Formula: C₁₅H₂₁ClN₂O₃
• Molecular Weight: 312.80
• CAS Registry Number: 99461-73-1
• SMILES: C1=C(COC(NC(C(CCl)=O)CCCCN)=O)C=CC=C1
• InChI: 1S/C15H21ClN2O3/c16-10-14(19)13(8-4-5-9-17)18-15(20)21-11-12-6-2-1-3-7-12/h1-3,6-7,13H,4-5,8-11,17H2,(H,18,20)
• InChIKey: XOLFBZSWIMNZGR-UHFFFAOYSA-N

Properties

• Density: 1.191g/cm³ (Cal.)
• Boiling point: 503.112°C at 760 mmHg (Cal.)
• Flash point: 258.073°C (Cal.)