2-Benzyloxy-5-nitrobenzenethiol

Base Information

• Chemical Name: 2-Benzyloxy-5-nitrobenzenethiol
• CAS No.: 887353-11-9
• Molecular Formula: C13H11 N O3 S
• Molecular Weight: 261.3
• DSSTox Substance ID: DTXSID70403428
• Wikidata: Q82207108
• Mol file: 887353-11-9.mol

Synonyms:2-BENZYLOXY-5-NITROBENZENETHIOL;887353-11-9;5-nitro-2-phenylmethoxybenzenethiol;Benzenethiol,5-nitro-2-(phenylmethoxy)-;2-Benzyloxy-5-nitrobenzenethiol (90%);DTXSID70403428;AKOS030254317;FT-0662971;2-Benzyloxy-5-nitrobenzenethiol (90per cent)

Chemical Property of 2-Benzyloxy-5-nitrobenzenethiol

Chemical Property:

• Vapor Pressure: 2.76E-07mmHg at 25°C
• Refractive Index: 1.646
• Boiling Point: 432.7°C at 760 mmHg
• Flash Point: 215.5°C
• PSA: 93.85000
• Density: 1.315g/cm³
• LogP: 3.98570
• Storage Temp.: -20°C Freezer, Under Inert Atmosphere
• Solubility.: Chloroform, DMSO, Ethyl Acetate
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 261.04596439
• Heavy Atom Count: 18
• Complexity: 276

Purity/Quality:

99% ^*data from raw suppliers

2-Benzyloxy-5-nitrobenzenethiol(90%) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])S