Thiocyanic acid, 2-methoxy-5-nitrobenzyl ester

Base Information

• Chemical Name: Thiocyanic acid, 2-methoxy-5-nitrobenzyl ester
• CAS No.: 73909-01-0
• Molecular Formula: C9H8N2O3S
• Molecular Weight: 224.2364
• DSSTox Substance ID: DTXSID90224490
• Wikidata: Q83103085
• Mol file: 73909-01-0.mol

Synonyms:Thiocyanic acid, 2-methoxy-5-nitrobenzyl ester;73909-01-0;2-Methoxy-5-nitrobenzyl thiocyanate;Thiocyanic acid, (2-methoxy-5-nitrophenyl)methyl ester;DTXSID90224490;LS-152707

Chemical Property of Thiocyanic acid, 2-methoxy-5-nitrobenzyl ester

Chemical Property:

• Vapor Pressure: 7.39E-07mmHg at 25°C
• Boiling Point: 407.7°C at 760 mmHg
• Flash Point: 200.4°C
• Density: 1.355g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 224.02556330
• Heavy Atom Count: 15
• Complexity: 270

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)[N+](=O)[O-])CSC#N