Bi(anthracene-9,10-dimethylene)
Basic information
- CAS
5672-97-9- Standard SMILES
c1ccc2c3c4ccccc4c(c2c1)CCc1c2ccccc2c(c2ccccc12)CC3- InChIKey
VCCYKNKAQTXXMJ-UHFFFAOYSA-N- Molecular formula
- C32H24
- Average molar mass
- 408.5 g/mol
- Monoisotopic mass
- 408.18780077
Names & identifiers
- Preferred name
- Bi(anthracene-9,10-dimethylene)
- IUPAC
- heptacyclo[12.6.6.64,11.05,10.015,20.021,26.027,32]dotriaconta-1(20),4(32),5,7,9,11(27),14,16,18,21,23,25,28,30-tetradecaene
- English name
- 5,16[1',2']:8,13[1'',2'']-Dibenzenodibenzo[a,g]cyclododecene, 6,7,14,15-tetrahydro-
- Molecular formula
- C32H24
- Molecular weight
- 408.53
Names & synonyms
Bi(anthracene-9,10-dimethylene)5672-97-9RefChem:3291085,16[1',2']:8,13[1'',2'']-Dibenzenodibenzo[a,g]cyclododecene, 6,7,14,15-tetrahydro-VCCYKNKAQTXXMJ-UHFFFAOYSA-NDTXSID401304065RCL S263699AKOS024428390cyclobis(anthracene-9,10-dimethylene)Heptacyclo[12.6.6.6~4,11~.0~5,10~.0~15,20~.0~21,26~.0~27,32~]dotriaconta-1(20),4,6,8,10,14,16,18,21,23,25,27,29,31-tetradecaene
Database identifiers
- CAS
5672-97-9- PubChem CID
- 609353
- DTXSID
DTXSID401304065- EC Number
- 105-268-3
- Nikkaji
- J1.391.718C
Properties
Computed structural properties
- XLogP
- 9.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 490
Physicochemical properties
- Boiling point
- 650.4 · 650.4±40.0 °C(Predicted)
- Density
- 1.208 · 1.208±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
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Compound notes
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