1,4:5,8-Dimethanonaphthalene, 1,4,5,8-tetrahydro-, (1alpha,4alpha,5beta,8beta)-
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Basic information
- CAS
97253-51-5- Standard SMILES
C1=CC2CC1C1=C2C2C=CC1C2- InChIKey
KWPLEXGYQPSPLP-UHFFFAOYSA-N- Molecular formula
- C12H12
- Average molar mass
- 156.22 g/mol
- Monoisotopic mass
- 156.09390038
Names & identifiers
- Preferred name
- 1,4:5,8-Dimethanonaphthalene, 1,4,5,8-tetrahydro-, (1alpha,4alpha,5beta,8beta)-
- IUPAC
- tetracyclo[6.2.1.13,6.02,7]dodeca-2(7),4,9-triene
- English name
- 1,4:5,8-Dimethanonaphthalene, 1,4,5,8-tetrahydro-, (1alpha,4alpha,5alp ha,8alpha)-
- Molecular formula
- C12H12
- Molecular weight
- 156.22
Names & synonyms
97806-44-597253-51-51,4:5,8-Dimethanonaphthalene, 1,4,5,8-tetrahydro-, (1alpha,4alpha,5beta,8beta)-DTXSID609136421,4:5,8-Dimethanonaphthalene, 1,4,5,8-tetrahydro-, (1alpha,4alpha,5alpha,8alpha)-1,4,5,8-Tetrahydro-1,4:5,8-dimethanonaphthalene1,4:5,8-Dimethanonaphthalene, 1,4,5,8-tetrahydro-, (1.alpha.,4.alpha.,5.alpha.,8.alpha.)-1,4:5,8-Dimethanonaphthalene, 1,4,5,8-tetrahydro-, (1.alpha.,4.alpha.,5.beta.,8.beta.)-syn-sesquinorbornatriene1,4:5,8-Dimethanonaphthalene, 1,4,5,8-tetrahydro-, (1alpha,4alpha,5alp ha,8alpha)-
Database identifiers
- CAS
97253-51-5、97806-44-5- PubChem CID
- 145303
- DTXSID
DTXSID60913642- Nikkaji
- J2.872.937E
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 281
Physicochemical properties
- Boiling point
- 257.826 · 257.826±40.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.167 · 1.167±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
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Related reactions
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Compound notes
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