1,2,3,4,5,6,7,8-Octahydro-4,7-dimethylnaphthalene-2-carbonitrile

Base Information

• Chemical Name: 1,2,3,4,5,6,7,8-Octahydro-4,7-dimethylnaphthalene-2-carbonitrile
• CAS No.: 94386-57-9
• Molecular Formula: C13H19 N
• Molecular Weight: 189.29666
• European Community (EC) Number: 305-280-0
• DSSTox Substance ID: DTXSID20915566
• Nikkaji Number: J382.788G
• Mol file: 94386-57-9.mol

Synonyms:94386-57-9;1,2,3,4,5,6,7,8-Octahydro-4,7-dimethylnaphthalene-2-carbonitrile;EINECS 305-280-0;4,7-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalene-2-carbonitrile;DTXSID20915566;1,2,3,4,5,6,7,8-Octahydro-4,7-dimethyl-2-naphthalenecarbonitrile

Chemical Property of 1,2,3,4,5,6,7,8-Octahydro-4,7-dimethylnaphthalene-2-carbonitrile

Chemical Property:

• Vapor Pressure: 0.000507mmHg at 25°C
• Boiling Point: 313.1°Cat760mmHg
• Flash Point: 115.8°C
• PSA: 23.79000
• Density: 0.97g/cm³
• LogP: 3.67268
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 189.151749610
• Heavy Atom Count: 14
• Complexity: 304

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCC2=C(C1)CC(CC2C)C#N

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