Thiocyanic acid, 2-bromoallyl ester

Base Information

• Chemical Name: Thiocyanic acid, 2-bromoallyl ester
• CAS No.: 102367-26-0
• Molecular Formula: C4H4 Br N S
• Molecular Weight: 178.0503
• NSC Number: 169070
• DSSTox Substance ID: DTXSID30144961
• Wikidata: Q83009270
• Mol file: 102367-26-0.mol

Synonyms:Thiocyanic acid, 2-bromoallyl ester;2-Bromoallyl thiocyanate;102367-26-0;Thiocyanic acid, 2-bromo-2-propenyl ester;DTXSID30144961;2-Bromo-3-thiocyanatoprop-1-ene;NSC169070;NSC-169070

Chemical Property of Thiocyanic acid, 2-bromoallyl ester

Chemical Property:

• Vapor Pressure: 0.0786mmHg at 25°C
• Boiling Point: 227.2°C at 760 mmHg
• Flash Point: 91.2°C
• Density: 1.618g/cm³
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 176.92478
• Heavy Atom Count: 7
• Complexity: 112

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=C(CSC#N)Br