Benzo[pqr]dinaphtho[8,1,2-bcd:2',1',8'-lmn]perylene
Basic information
- CAS
188-11-4- Standard SMILES
c1cc2ccc3ccc4c5ccc6ccc7cccc8c9ccc%10c(c1)c2c3c4c%10c9c5c6c78- InChIKey
QJXFDAOHACWBIA-UHFFFAOYSA-N- Molecular formula
- C34H16
- Average molar mass
- 424.5 g/mol
- Monoisotopic mass
- 424.12520051
Names & identifiers
- Preferred name
- Benzo[pqr]dinaphtho[8,1,2-bcd:2',1',8'-lmn]perylene
- IUPAC
- decacyclo[20.12.0.02,7.03,32.06,11.08,21.09,18.010,15.025,34.028,33]tetratriaconta-1(22),2,4,6,8(21),9(18),10(15),11,13,16,19,23,25(34),26,28(33),29,31-heptadecaene
- English name
- Benzo[pqr]dinaphtho[8,1,2-bcd:2',1',8'-lmn]perylene
- Molecular formula
- C34H16
- Molecular weight
- 424.49084
Names & synonyms
188-11-4Benzo[pqr]dinaphtho[8,1,2-bcd:2',1',8'-lmn]peryleneBenzo(pqr)dinaphtho(8,1,2-bcd:2,1,8-lmn)perylenedecacyclo[20.12.0.02,7.03,32.06,11.08,21.09,18.010,15.025,34.028,33]tetratriaconta-1(22),2,4,6,8(21),9(18),10(15),11,13,16,19,23,25(34),26,28(33),29,31-heptadecaeneBenzo[pqr]dinaphtho[8,1,2-bcd:2,1,8-lmn]peryleneSCHEMBL4851865SCHEMBL31177926SCHEMBL40544761DTXSID80172133Benzo[rst]dinaphtho[2,1,8,7-defg:2',1',8',7'-ijkl]pentapheneBenzo[pgr]dinaphtho[8,1,2-bcd:2',1',8'-lmn]perylene
Database identifiers
- CAS
188-11-4- PubChem CID
- 135993
- DTXSID
DTXSID80172133- Nikkaji
- J683.714J
Properties
Computed structural properties
- XLogP
- 9.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 788
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Compound notes
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