Basic information
- CAS
54100-61-7- Standard SMILES
C1=c2ccc3c4cccccc-4c4ccc(c2c43)CC1- InChIKey
INCARXSKHJSGDH-UHFFFAOYSA-N- Molecular formula
- C20H14
- Average molar mass
- 254.3 g/mol
- Monoisotopic mass
- 254.10955045
Names & identifiers
- Preferred name
- Azuleno(1,2,3-cd)phenalene, 4,5-dihydro-
- IUPAC
- pentacyclo[10.6.2.02,8.09,19.016,20]icosa-1(19),2,4,6,8,10,12,16(20),17-nonaene
- English name
- 4,5-Dihydroazuleno(1,2,3-cd)phenalene
- Molecular formula
- C20H14
- Molecular weight
- 254.33
Names & synonyms
Azuleno(1,2,3-cd)phenalene, 4,5-dihydro-54100-61-74,5-Dihydroazuleno(1,2,3-cd)phenaleneDTXSID802024491,2-dihydroazuleno[1,2,3-cd]phenaleneAzuleno[1,2,3-cd]phenalene, 4,5-dihydro-
Database identifiers
- CAS
54100-61-7- PubChem CID
- 148658
- DTXSID
DTXSID80202449
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 457
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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