Basic information
- CAS
201-65-0- Standard SMILES
c1ccc2c(c1)Cc1c-2c2ccccc2c2ccccc12- InChIKey
XNKVIGSNRYAOQZ-UHFFFAOYSA-N- Molecular formula
- C21H14
- Average molar mass
- 266.3 g/mol
- Monoisotopic mass
- 266.10955045
Names & identifiers
- Preferred name
- 13H-Indeno(1,2-l)phenanthrene
- IUPAC
- pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene
- English name
- 13H-Indeno[1,2-l]phenanthrene
- Molecular formula
- C21H14
- Molecular weight
- 266.34
Names & synonyms
1,2,3,4-Dibenzfluorene13H-Dibenzo(a,c)fluorene13H-Indeno(1,2-1)phenanthrene13H-Indeno(1,2-l)phenanthreneL77849WNUX201-65-013H-Indeno[1,2-l]phenanthreneJ36.991HDTXSID10942124RefChem:1057488DTXCID401370539Dibenzofluorene
Show more names
BRN 1967121UNII-L77849WNUX73560-78-89,10-(1,2-PHENYLENEMETHYLENE)PHENANTHRENESCHEMBL142642SCHEMBL151172SCHEMBL992290SCHEMBL17063433
Database identifiers
- CAS
201-65-0、73560-78-8- PubChem CID
- 71071
- DTXSID
DTXSID10942124- UNII
- L77849WNUX
- Nikkaji
- J36.991H
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 385
Physicochemical properties
- Melting point
- 158 · 158-159 °C
- Boiling point
- 344.54 °C · 344.54°C (rough estimate)
- Density
- 1.134 · 1.1340 (estimate)
- refractive index
- 1.764 · 1.7640 (estimate)
- FDA UNII
- 77849 WNUX · L77849WNUX
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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