12-n-Octyl-1,2,3,4,5,6,6a,7,8,9,10,10a-dodecahydrochrysene

Base Information

• Chemical Name: 12-n-Octyl-1,2,3,4,5,6,6a,7,8,9,10,10a-dodecahydrochrysene
• CAS No.: 55281-94-2
• Molecular Formula: C26H40
• Molecular Weight: 352.6
• NSC Number: 112734
• DSSTox Substance ID: DTXSID70296933
• Nikkaji Number: J114.069H
• Mol file: 55281-94-2.mol

Synonyms:55281-94-2;12-n-Octyl-1,2,3,4,5,6,6a,7,8,9,10,10a-dodecahydrochrysene;Chrysene, 1,2,3,4,4a,7,8,9,10,11,12,12a-dodecahydro-6-octyl-;NSC112734;DTXSID70296933;QMLSEQMTIVHKQP-UHFFFAOYSA-N;NSC-112734;12-n-Octyl-1,3,4,5,6,6a,7,8,9,10,10a-dodecahydrochrysene;Chrysene,2,3,4,4a,7,8,9,10,11,12,12a-dodecahydro-6-octyl-;6-Octyl-1,2,3,4,4a,7,8,9,10,11,12,12a-dodecahydrochrysene #

Chemical Property of 12-n-Octyl-1,2,3,4,5,6,6a,7,8,9,10,10a-dodecahydrochrysene

Chemical Property:

• Vapor Pressure: 1.43E-08mmHg at 25°C
• Boiling Point: 470.4°C at 760 mmHg
• Flash Point: 244.6°C
• PSA: 0.00000
• Density: 0.96g/cm³
• LogP: 7.68840
• XLogP3: 10.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 7
• Exact Mass: 352.313001276
• Heavy Atom Count: 26
• Complexity: 412

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC1=CC2=C(CCC3C2CCCC3)C4=C1CCCC4

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