1,2,6,7-Tetrahydrocyclohepta[fg]acenaphthylene-5,8-dione

Base Information

• Chemical Name: 1,2,6,7-Tetrahydrocyclohepta[fg]acenaphthylene-5,8-dione
• CAS No.: 6345-20-6
• Molecular Formula: C₁₆H₁₂O₂
• Molecular Weight: 236.27
• NSC Number: 47098
• DSSTox Substance ID: DTXSID80979664
• Nikkaji Number: J1.801.891H
• Wikidata: Q82965371
• ChEMBL ID: CHEMBL1880953

Synonyms:1,2,6,7-tetrahydrocyclohepta[fg]acenaphthylene-5,8-dione;MLS002608802;6345-20-6;SMR001527543;NSC47098;cid_240668;CHEMBL1880953;SCHEMBL21948632;BDBM96137;DTXSID80979664;HMS3080P21;NSC-47098;tetracyclo[7.5.2.04,16.012,15]hexadeca-1(15),2,4(16),9,11-pentaene-5,8-dione

Chemical Property of 1,2,6,7-Tetrahydrocyclohepta[fg]acenaphthylene-5,8-dione

Chemical Property:

• Vapor Pressure: 5.49E-09mmHg at 25°C
• Boiling Point: 469.5°C at 760 mmHg
• Flash Point: 174.5°C
• Density: 1.352g/cm³
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 236.083729621
• Heavy Atom Count: 18
• Complexity: 364

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2=CC=C3C(=O)CCC(=O)C4=C3C2=C1C=C4

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