3-(5-Formylthiophen-2-yl)benzonitrile

Base Information

• Chemical Name: 3-(5-Formylthiophen-2-yl)benzonitrile
• CAS No.: 886508-88-9
• Molecular Formula: C12H7NOS
• Molecular Weight: 213.26
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID001295935
• Mol file: 886508-88-9.mol

Synonyms:3-(5-formylthiophen-2-yl)benzonitrile;886508-88-9;3-(5-formyl-2-thienyl)benzonitrile;C12H7NOS;3-(5-Formyl-thiophen-2-yl)-benzonitrile;SCHEMBL2018612;DTXSID001295935;AC7649;MFCD06410198;AKOS004113931;AB24098;SY015093;BB 0222861;CS-0326054;FT-0754397;A861583;3-(5-formyl-thiophen-2-yl)-benzonitrile, AldrichCPR

Chemical Property of 3-(5-Formylthiophen-2-yl)benzonitrile

Chemical Property:

• Boiling Point: 407.0±40.0 °C(Predicted)
• PSA: 69.10000
• Density: 1.30±0.1 g/cm3(Predicted)
• LogP: 3.09928
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 213.02483502
• Heavy Atom Count: 15
• Complexity: 283

Purity/Quality:

98%min ^*data from raw suppliers

3-(5-Formyl-2-thienyl)benzonitrile ^*data from reagent suppliers

Safty Information:

• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)C2=CC=C(S2)C=O)C#N