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Phenyl[4-Phenyl-8-(Trifluoromethyl)Quinolin-3-yl]Methanol

HCID 11222693
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
OC(c1ccccc1)c1cnc2c(C(F)(F)F)cccc2c1-c1ccccc1
InChIKey
VLDPJNJNFWQILK-UHFFFAOYSA-N
Molecular formula
C23H16F3NO
Average molar mass
379.4 g/mol

Names & identifiers

Preferred name
Phenyl[4-Phenyl-8-(Trifluoromethyl)Quinolin-3-yl]Methanol
IUPAC
phenyl-[4-phenyl-8-(trifluoromethyl)quinolin-3-yl]methanol

Names & synonyms

Phenyl[4-Phenyl-8-(Trifluoromethyl)Quinolin-3-yl]MethanolSCHEMBL1124313

Database identifiers

PubChem CID
11222693

Properties

Computed structural propertiesFilling in

XLogP
5.5
Topological polar surface area
33.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
28
Formal charge
0
Complexity
499

Related reactions

6 records
New reaction record
HRID 289262 reaction equation
HRID 289262As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 310926 reaction equation
HRID 310926As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1567358 reaction equation
HRID 1567358As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2104492 reaction equation
HRID 2104492As productuspto-grants-2009_08
HRID 2104493 reaction equation
HRID 2104493As reactantuspto-grants-2009_08
HRID 2104494 reaction equation
HRID 2104494As reactantuspto-grants-2009_08

Compound notes

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