2-{[2-(2-Hydroxyethanesulfonyl)-4-nitrophenyl]sulfanyl}ethan-1-ol

Base Information

• Chemical Name: 2-{[2-(2-Hydroxyethanesulfonyl)-4-nitrophenyl]sulfanyl}ethan-1-ol
• CAS No.: 100983-99-1
• Molecular Formula: C10H13NO6S2
• DSSTox Substance ID: DTXSID90545410
• Wikidata: Q82422895
• Mol file: 100983-99-1.mol

Synonyms:100983-99-1;SCHEMBL9877837;DTXSID90545410;HJFXOYNTGHQNHQ-UHFFFAOYSA-N;2-{[2-(2-Hydroxyethanesulfonyl)-4-nitrophenyl]sulfanyl}ethan-1-ol;2-beta-Hydroxyethylmercapto-5-nitrophenyl hydroxyethyl sulfone

Chemical Property of 2-{[2-(2-Hydroxyethanesulfonyl)-4-nitrophenyl]sulfanyl}ethan-1-ol

Chemical Property:

• XLogP3: 0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 307.01842948
• Heavy Atom Count: 19
• Complexity: 388

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)CCO)SCCO