3,7-Octadienenitrile, 3,7-dimethyl-

Base Information

• Chemical Name: 3,7-Octadienenitrile, 3,7-dimethyl-
• CAS No.: 31945-18-3
• Molecular Formula: C10H15 N
• Molecular Weight: 149.2328
• European Community (EC) Number: 250-869-7
• DSSTox Substance ID: DTXSID3067651
• Nikkaji Number: J278.209J
• Wikidata: Q76386824
• Mol file: 31945-18-3.mol

Synonyms:3,7-Dimethylocta-3,7-dienenitrile;3,7-Octadienenitrile, 3,7-dimethyl-;31945-18-3;3,7-Dimethyl-3,7-octadienenitrile;EINECS 250-869-7;DTXSID3067651;AKOS006326425

Chemical Property of 3,7-Octadienenitrile, 3,7-dimethyl-

Chemical Property:

• Vapor Pressure: 0.023mmHg at 25°C
• Boiling Point: 249.4°Cat760mmHg
• Flash Point: 110.4°C
• PSA: 23.79000
• Density: 0.851g/cm³
• LogP: 3.20268
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 149.120449483
• Heavy Atom Count: 11
• Complexity: 202

Purity/Quality:

99% ^*data from raw suppliers

3,7-DIMETHYLOCTA-3,7-DIENENITRILE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=C)CCC=C(C)CC#N
• Isomeric SMILES: CC(=C)CC/C=C(\C)/CC#N

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