Bis[N,N-bis(2-chloroethyl)carbamic acid](1,2-diethyl-1,2-ethenediyl)di(4,1-phenylene) ester
[CAS# 991-23-1]

Identification

• Name: Bis[N,N-bis(2-chloroethyl)carbamic acid](1,2-diethyl-1,2-ethenediyl)di(4,1-phenylene) ester
• Synonyms: [4-[4-[4-[Bis(2-Chloroethyl)Carbamoyloxy]Phenyl]Hex-3-En-3-Yl]Phenyl] N,N-Bis(2-Chloroethyl)Carbamate; [4-[2-[4-[Bis(2-Chloroethyl)Carbamoyloxy]Phenyl]-1-Ethyl-But-1-Enyl]Phenyl] N,N-Bis(2-Chloroethyl)Carbamate; [4-[(E)-2-[4-[Bis(2-Chloroethyl)Carbamoyloxy]
• Molecular Formula: C₂₈H₃₄Cl₄N₂O₄
• Molecular Weight: 604.40
• CAS Registry Number: 991-23-1 (15470-58-3)
• SMILES: C1=CC(=CC=C1C(=C(C2=CC=C(C=C2)OC(N(CCCl)CCCl)=O)\CC)/CC)OC(N(CCCl)CCCl)=O
• InChI: 1S/C28H34Cl4N2O4/c1-3-25(21-5-9-23(10-6-21)37-27(35)33(17-13-29)18-14-30)26(4-2)22-7-11-24(12-8-22)38-28(36)34(19-15-31)20-16-32/h5-12H,3-4,13-20H2,1-2H3/b26-25+
• InChIKey: BOIZOYRDXIYMCY-OCEACIFDSA-N

Properties

• Density: 1.26g/cm³ (Cal.)
• Boiling point: 671.135°C at 760 mmHg (Cal.)
• Flash point: 359.69°C (Cal.)