Basic information
- CAS
4670-86-4- Standard SMILES
c1ccc2c(c1)c1ccccc3c4ccccc4c2c13- InChIKey
UCOHDDVPRHMZGK-UHFFFAOYSA-N- Molecular formula
- C20H12
- Average molar mass
- 252.3 g/mol
- Monoisotopic mass
- 252.09390038
Names & identifiers
- Preferred name
- Benz(a)indeno(1,2,3-cd)azulene
- IUPAC
- pentacyclo[11.6.1.02,7.08,20.014,19]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene
- English name
- Benz[a]indeno[1,2,3-cd]azulene
- Molecular formula
- C20H12
- Molecular weight
- 252.30928
Names & synonyms
Benz[a]indeno[1,2,3-cd]azuleneBenz(a)indeno(1,2,3-cd)azulene4670-86-4DTXSID20196919RefChem:321051DTXCID10119410Benzo[a]indeno[1,2,3-cd]azulene
Database identifiers
- CAS
4670-86-4- PubChem CID
- 138317
- DTXSID
DTXSID20196919- Nikkaji
- J283.916D
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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