Ethanesulfonic acid, 2-(bis(2-chloroethyl)amino)-, phenyl ester

Base Information

• Chemical Name: Ethanesulfonic acid, 2-(bis(2-chloroethyl)amino)-, phenyl ester
• CAS No.: 5908-54-3
• Molecular Formula: C12H17 Cl2 N O3 S
• Molecular Weight: 326.24
• DSSTox Substance ID: DTXSID30207808
• Wikidata: Q83081808
• Mol file: 5908-54-3.mol

Synonyms:5908-54-3;Ethanesulfonic acid, 2-(bis(2-chloroethyl)amino)-, phenyl ester;Phenyl 2-(bis(2-chloroethyl)amino)ethanesulfonate;phenyl 2-[bis(2-chloroethyl)amino]ethanesulfonate;DTXSID30207808

Chemical Property of Ethanesulfonic acid, 2-(bis(2-chloroethyl)amino)-, phenyl ester

Chemical Property:

• Vapor Pressure: 2.46E-06mmHg at 25°C
• Boiling Point: 391.5°Cat760mmHg
• Flash Point: 190.5°C
• PSA: 54.99000
• Density: 1.32g/cm³
• LogP: 3.25560
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 325.0306200
• Heavy Atom Count: 19
• Complexity: 320

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OS(=O)(=O)CCN(CCCl)CCCl