tFPO-CF2-5HidFP

HCID 175685891

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Basic information

CAS: 1393833-09-4
Standard SMILES: CCCCCC1Cc2ccc(-c3cc(F)c(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)cc2C1
InChIKey: SNBKGGXDTRHMIQ-UHFFFAOYSA-N
Molecular formula: C27H23F7O
Average molar mass: 496.5 g/mol
Monoisotopic mass: 496.16371249

Names & identifiers

Preferred name: tFPO-CF2-5HidFP
IUPAC: 5-[4-[difluoro-(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]-2-pentyl-2,3-dihydro-1H-indene

Names & synonyms

tFPO-CF2-5HidFPDTXSID5013782291393833-09-45-(4-(difluoro(3,4,5-trifluorophenoxy)methyl)-3,5-difluorophenyl)-2-pentyl-2,3-dihydro-1H-indene5-[4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-3,5-difluorophenyl]-2,3-dihydro-2-pentyl-1H-indene

Database identifiers

CAS: 1393833-09-4
PubChem CID: 175685891
DTXSID: DTXSID501378229

Properties

Computed structural properties

XLogP: 9.5
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 8
Rotatable bonds: 8
Heavy atoms: 35
Formal charge: 0
Complexity: 654

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