Benzo(H)naphtho(1,2,3,4-rst)pentaphene
Basic information
- CAS
31541-02-3- Standard SMILES
c1ccc2c(c1)cc1c3ccccc3c3cc4ccccc4c4c5ccccc5c2c1c34- InChIKey
XZANXBBTFLJEIN-UHFFFAOYSA-N- Molecular formula
- C32H18
- Average molar mass
- 402.5 g/mol
- Monoisotopic mass
- 402.14085057
Names & identifiers
- Preferred name
- Benzo(H)naphtho(1,2,3,4-rst)pentaphene
- IUPAC
- octacyclo[14.14.2.02,7.08,32.09,14.017,22.023,31.025,30]dotriaconta-1(31),2,4,6,8(32),9,11,13,15,17,19,21,23,25,27,29-hexadecaene
Names & synonyms
Benzo[h]naphtho[1,2,3,4-rst]pentaphene31541-02-3BENZO(H)NAPHTHO(1,2,3,4-RST)PENTAPHENEBenzo[a]naphtho[1,2,3,4-klm]piceneSCHEMBL4846672DTXSID80185440
Database identifiers
- CAS
31541-02-3- PubChem CID
- 35837
- DTXSID
DTXSID80185440- Nikkaji
- J1.615.972G
Properties
Computed structural properties
- XLogP
- 9.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 649
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Compound notes
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