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DIBENZO(b,def)CHRYSENE, 3,4-DIHYDRO-

HCID 52218
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Basic information

CAS
73691-48-2
Standard SMILES
C1=Cc2cc3ccc4c5ccccc5cc5ccc(c2CC1)c3c54
InChIKey
BBKQYMUFWXRFHP-UHFFFAOYSA-N
Molecular formula
C24H16
Average molar mass
304.4 g/mol
Monoisotopic mass
304.12520051

Names & identifiers

Preferred name
DIBENZO(b,def)CHRYSENE, 3,4-DIHYDRO-
IUPAC
hexacyclo[10.10.2.02,7.09,23.013,18.020,24]tetracosa-1(23),2,4,6,8,10,12(24),13(18),16,19,21-undecaene

Names & synonyms

DIBENZO(b,def)CHRYSENE, 3,4-DIHYDRO-73691-48-2BRN 19852943,4-Dihydrodibenzo(a,h)pyreneDTXSID302239823,4-Dihydrodibenzo[c,pqr]tetraphene

Database identifiers

CAS
73691-48-2
PubChem CID
52218
DTXSID
DTXSID30223982
Nikkaji
J72.791A

Properties

Computed structural properties

XLogP
7.1
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
24
Formal charge
0
Complexity
518

Related reactions

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Compound notes

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