cis-8a-Methyl-3-oxodecahydro-4a-naphthalenecarbonitrile

Base Information

• Chemical Name: cis-8a-Methyl-3-oxodecahydro-4a-naphthalenecarbonitrile
• CAS No.: 880-38-6
• Molecular Formula: C12H17NO
• DSSTox Substance ID: DTXSID20511209
• Nikkaji Number: J2.609.797E
• Wikidata: Q82369906
• Mol file: 880-38-6.mol

Synonyms:880-38-6;cis-8a-Methyl-3-oxodecahydro-4a-naphthalenecarbonitrile;DTXSID20511209;VDTIJFRUZIAMNB-NEPJUHHUSA-N;8a-Methyl-3-oxooctahydro-4a(2H)-naphthalenecarbonitrile #;(4aR,8aR)-8a-Methyl-3-oxooctahydronaphthalene-4a(2H)-carbonitrile

Chemical Property of cis-8a-Methyl-3-oxodecahydro-4a-naphthalenecarbonitrile

Chemical Property:

• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 191.131014166
• Heavy Atom Count: 14
• Complexity: 314

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12CCCCC1(CC(=O)CC2)C#N
• Isomeric SMILES: C[C@]12CCCC[C@]1(CC(=O)CC2)C#N