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tFPO-CF2-5HiFP

HCID 175684833
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
1400815-12-4
Standard SMILES
CCCCCC1Cc2ccc(-c3ccc(C(F)(F)Oc4cc(F)c(F)c(F)c4)c(F)c3)cc2C1
InChIKey
DASHVEOYHFPNKO-UHFFFAOYSA-N
Molecular formula
C27H24F6O
Average molar mass
478.5 g/mol
Monoisotopic mass
478.17313436

Names & identifiers

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

Names & synonyms

tFPO-CF2-5HiFPDTXSID8013780281400815-12-45-(4-(difluoro(3,4,5-trifluorophenoxy)methyl)-3-fluorophenyl)-2-pentyl-2,3-dihydro-1H-indene5-[4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-3-fluorophenyl]-2,3-dihydro-2-pentyl-1H-indene

Database identifiers

CAS
1400815-12-4
PubChem CID
175684833
DTXSID
DTXSID801378028

Properties

Computed structural properties

XLogP
9.4
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
34
Formal charge
0
Complexity
635

Related reactions

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Compound notes

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