Disodium (((4-((sulphonatomethyl)amino)phenyl)sulphonyl)amino)methanesulphonate

Base Information

• Chemical Name: Disodium (((4-((sulphonatomethyl)amino)phenyl)sulphonyl)amino)methanesulphonate
• CAS No.: 94135-88-3
• Molecular Formula: C8H12 N2 O8 S3 . 2 Na
• Molecular Weight: 404.34814
• European Community (EC) Number: 302-959-3
• UNII: LL5T8F89CK
• DSSTox Substance ID: DTXSID50240772
• Nikkaji Number: J368.325G
• Mol file: 94135-88-3.mol

Synonyms:94135-88-3;LL5T8F89CK;Disodium (((4-((sulphonatomethyl)amino)phenyl)sulphonyl)amino)methanesulphonate;EINECS 302-959-3;UNII-LL5T8F89CK;Disodium (((4-((sulfonatomethyl)amino)phenyl)sulfonyl)amino)methanesulfonate;Disodium [[[4-[(sulphonatomethyl)amino]phenyl]sulphonyl]amino]methanesulphonate;C8H12N2O8S3.2Na;DTXSID50240772;C8-H12-N2-O8-S3.2Na;[[[4-[[[(Sodiooxy)sulfonyl]methyl]amino]phenyl]sulfonyl]amino]methanesulfonic acid sodium salt;METHANESULFONIC ACID, (((4-((SULFOMETHYL)AMINO)PHENYL)SULFONYL)AMINO)-, DISODIUM SALT

Chemical Property of Disodium (((4-((sulphonatomethyl)amino)phenyl)sulphonyl)amino)methanesulphonate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 197.74000
• Density: g/cm³
• LogP: 2.08850
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 5
• Exact Mass: 403.93946737
• Heavy Atom Count: 23
• Complexity: 603

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NCS(=O)(=O)[O-])S(=O)(=O)NCS(=O)(=O)[O-].[Na+].[Na+]