Einecs 278-071-4

Base Information

• Chemical Name: Einecs 278-071-4
• CAS No.: 75113-57-4
• Deprecated CAS: 99728-49-1
• Molecular Formula: C13H19NO4S.C2H7NO
• Molecular Weight: 346.44234
• European Community (EC) Number: 278-071-4
• DSSTox Substance ID: DTXSID3072799
• Mol file: 75113-57-4.mol

Synonyms:EINECS 278-071-4;75113-57-4;6-(Methyl(phenylsulphonyl)amino)hexanoic acid, compound with 2-aminoethanol (1:1);6-[methyl(phenylsulphonyl)amino]hexanoic acid, compound with 2-aminoethanol (1:1);C13H19NO4S.C2H7NO;DTXSID3072799;C13-H19-N-O4-S.C2-H7-N-O

Chemical Property of Einecs 278-071-4

Chemical Property:

• Vapor Pressure: 2.01E-09mmHg at 25°C
• Boiling Point: 464.4°C at 760 mmHg
• Flash Point: 234.7°C
• PSA: 129.31000
• LogP: 2.67060
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 346.15624311
• Heavy Atom Count: 23
• Complexity: 379

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(CCCCCC(=O)O)S(=O)(=O)C1=CC=CC=C1.C(CO)N