2,3,4-Trifluorophenyl p-pentylbenzoate

HCID 14495651
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Basic information

Standard SMILES
CCCCCc1ccc(C(=O)Oc2ccc(F)c(F)c2F)cc1
InChIKey
ZZPFQEWYZGZYOE-UHFFFAOYSA-N
Molecular formula
C18H17F3O2
Average molar mass
322.3 g/mol

Names & identifiers

Preferred name
2,3,4-Trifluorophenyl p-pentylbenzoate
IUPAC
(2,3,4-trifluorophenyl) 4-pentylbenzoate

Names & synonyms

SCHEMBL9406257ZZPFQEWYZGZYOE-UHFFFAOYSA-N2,3,4-trifluorophenyl p-pentylbenzoate4-Pentyl-benzoic acid 2,3,4-trifluoro-phenyl ester

Database identifiers

PubChem CID
14495651

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
23

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical structure

Related reactions

1 records
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Compound notes

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