BebcHdFEtOdFP

HCID 175685255

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Basic information

Standard SMILES: C=CCCC1CCC(C2CCC(c3ccc(OCC(F)F)c(F)c3F)CC2)CC1
InChIKey: JOCWFFNAOSLVEN-UHFFFAOYSA-N
Molecular formula: C24H32F4O
Average molar mass: 412.5 g/mol
Monoisotopic mass: 412.23892829

Names & identifiers

Preferred name: BebcHdFEtOdFP
IUPAC: 1-[4-(4-but-3-enylcyclohexyl)cyclohexyl]-4-(2,2-difluoroethoxy)-2,3-difluorobenzene

Names & synonyms

BebcHdFEtOdFPDTXSID2013808034-(but-3-en-1-yl)-4'-(4-(2,2-difluoroethoxy)-2,3-difluorophenyl)-1,1'-bi(cyclohexane)4-(but-3-en-1-yl)-4'-[4-(2,2-difluoroethoxy)-2,3-difluorophenyl]-1,1'-bi(cyclohexyl)

Database identifiers

PubChem CID: 175685255
DTXSID: DTXSID201380803

Properties

Computed structural properties

XLogP: 9.3
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 8
Heavy atoms: 29
Formal charge: 0
Complexity: 483

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