dFPO-CF2-3cHdFP

HCID 175685676

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Basic information

CAS: 208338-74-3
Standard SMILES: CCCC1CCC(c2cc(F)c(C(F)(F)Oc3ccc(F)c(F)c3)c(F)c2)CC1
InChIKey: PNBSHLLGNIPPRY-UHFFFAOYSA-N
Molecular formula: C22H22F6O
Average molar mass: 416.4 g/mol
Monoisotopic mass: 416.15748429

Names & identifiers

Preferred name: dFPO-CF2-3cHdFP
IUPAC: 2-[(3,4-difluorophenoxy)-difluoromethyl]-1,3-difluoro-5-(4-propylcyclohexyl)benzene

Names & synonyms

dFPO-CF2-3cHdFPDTXSID8013802132-((3,4-difluorophenoxy)difluoromethyl)-1,3-difluoro-5-(4-propylcyclohexyl)benzene2-[(3,4-Difluorophenoxy)difluoromethyl]-1,3-difluoro-5-(trans-4-propylcyclohexyl)benzene208338-74-3

Database identifiers

CAS: 208338-74-3
PubChem CID: 175685676
DTXSID: DTXSID801380213

Properties

Computed structural properties

XLogP: 8.4
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 6
Heavy atoms: 29
Formal charge: 0
Complexity: 498

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