Pyrene, 10b,10c-dihydro-10b,10c-dimethyl-, trans-

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Basic information

CAS: 956-84-3
Standard SMILES: CC12C3=CC=CC1=CC=C1C=CC=C(C=C3)C12C
InChIKey: SHCAFRNIXFPCQX-UHFFFAOYSA-N
Molecular formula: C18H16
Average molar mass: 232.3 g/mol
Monoisotopic mass: 232.12520051

Names & identifiers

Preferred name: Pyrene, 10b,10c-dihydro-10b,10c-dimethyl-, trans-
IUPAC: 10b,10c-dimethylpyrene

Names & synonyms

10b,10c-Dimethyl-10b,10c-dihydropyrenePyrene, 10b,10c-dihydro-10b,10c-dimethyl-, trans-60082-16-8956-84-310b,10c-dihydro-10b,10c-dimethyl-pyrenePyrene,10b,10c-dihydro-10b,10c-dimethyl-,trans-SCHEMBL23392594SCHEMBL23392595DTXSID40241894DB-301266

Database identifiers

CAS: 956-84-3
PubChem CID: 136771
DTXSID: DTXSID40241894
Nikkaji: J627.719E、J722.273D、J90.087G

Properties

Computed structural properties

XLogP: 4.9
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 0
Heavy atoms: 18
Formal charge: 0
Complexity: 552

Experimental & physicochemical properties

SpringerMaterials PropertiesDiamagnetic susceptibility

Related reactions

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Compound notes

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