(3-formyl-1H-indol-1-yl)acetonitrile

Base Information

• Chemical Name: (3-formyl-1H-indol-1-yl)acetonitrile
• CAS No.: 328973-78-0
• Molecular Formula: C11H8N2O
• Molecular Weight: 184.19
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID00354318
• Wikidata: Q82132384
• Mol file: 328973-78-0.mol

Synonyms:(3-formyl-1H-indol-1-yl)acetonitrile;328973-78-0;2-(3-formyl-1H-indol-1-yl)acetonitrile;2-(3-formylindol-1-yl)acetonitrile;DTXSID00354318;MFCD01785676;STK365098;AKOS000289140;CS-0246934;FT-0758924;EN300-3480569;(3-Formyl-1H-indol-1-yl)acetonitrile, AldrichCPR;Z57627123

Chemical Property of (3-formyl-1H-indol-1-yl)acetonitrile

Chemical Property:

• Boiling Point: 407.7±25.0 °C(Predicted)
• PSA: 45.79000
• Density: 1.16±0.1 g/cm3(Predicted)
• LogP: 1.97738
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 184.063662883
• Heavy Atom Count: 14
• Complexity: 268

Purity/Quality:

99%min ^*data from raw suppliers

(3-Formyl-1H-indol-1-yl)acetonitrile ^*data from reagent suppliers

Safty Information:

• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=CN2CC#N)C=O