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[6-[2-(3-Methoxypropyl)phenyl]-4-(trifluoromethyl)pyridin-3-yl]methanol

HCID 67448255
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COCCCc1ccccc1-c1cc(C(F)(F)F)c(CO)cn1
InChIKey
XKPHFFIVAMIEKK-UHFFFAOYSA-N
Molecular formula
C17H18F3NO2
Average molar mass
325.32 g/mol

Names & identifiers

Preferred name
[6-[2-(3-Methoxypropyl)phenyl]-4-(trifluoromethyl)pyridin-3-yl]methanol
IUPAC
[6-[2-(3-methoxypropyl)phenyl]-4-(trifluoromethyl)-3-pyridinyl]methanol

Names & synonyms

[6-[2-(3-methoxypropyl)phenyl]-4-(trifluoromethyl)pyridin-3-yl]methanolSCHEMBL2548718

Database identifiers

PubChem CID
67448255

Properties

Computed structural properties

XLogP
3
Topological polar surface area
42.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
23
Formal charge
0
Complexity
351

Related reactions

4 records
New reaction record
HRID 1148427 reaction equation
HRID 1148427As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 2194897 reaction equation
HRID 2194897As productuspto-grants-2012_12
HRID 2194898 reaction equation
HRID 2194898As reactantuspto-grants-2012_12
HRID 2341908 reaction equation
HRID 2341908As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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