2-[4-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Butanoyloxy]Ethyl (Z)-Octadec-9-Enoate
[CAS# 130676-88-9]

Identification

• Name: 2-[4-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Butanoyloxy]Ethyl (Z)-Octadec-9-Enoate
• Synonyms: (Z)-Octadec-9-Enoic Acid 2-[4-[4-[Bis(2-Chloroethyl)Amino]Phenyl]-1-Oxobutoxy]Ethyl Ester; (Z)-Octadec-9-Enoic Acid 2-[4-[4-[Bis(2-Chloroethyl)Amino]Phenyl]Butanoyloxy]Ethyl Ester; Benzenebutanoic Acid, 4-(Bis(2-Chloroethyl)Amino)-, 2-((1-Oxo-9-Octadecenyl)Oxy)Ethyl Ester, (Z)-
• Molecular Formula: C₃₄H₅₅Cl₂NO₄
• Molecular Weight: 612.72
• CAS Registry Number: 130676-88-9
• SMILES: C1=C(C=CC(=C1)CCCC(OCCOC(=O)CCCCCCC\C=C/CCCCCCCC)=O)N(CCCl)CCCl
• InChI: 1S/C34H55Cl2NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-33(38)40-29-30-41-34(39)20-17-18-31-21-23-32(24-22-31)37(27-25-35)28-26-36/h9-10,21-24H,2-8,11-20,25-30H2,1H3/b10-9-
• InChIKey: JURXPCSUZDDGRL-KTKRTIGZSA-N

Properties

• Density: 1.057g/cm³ (Cal.)
• Boiling point: 673.456°C at 760 mmHg (Cal.)
• Flash point: 361.093°C (Cal.)