[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol

C8H5ClF5NO — CID 118839527

IUPAC[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol
SMILESOCc1cc(Cl)c(C(F)F)c(C(F)(F)F)n1
InChIInChI=1S/C8H5ClF5NO/c9-4-1-3(2-16)15-6(8(12,13)14)5(4)7(10)11/h1,7,16H,2H2
InChIKeyCEUVIRRGOJHMLW-UHFFFAOYSA-N
MW261.58 g/mol
LogP3.18
Rot. Bonds2

About [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol

[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol (PubChem CID 118839527) has the molecular formula C8H5ClF5NO and a molecular weight of 261.58 g/mol. Its IUPAC name is [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol
PubChem CID118839527
Molecular FormulaC8H5ClF5NO
Molecular Weight261.58 g/mol
Exact Mass261.00
IUPAC Name[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol
SMILESOCc1cc(Cl)c(C(F)F)c(C(F)(F)F)n1
InChIInChI=1S/C8H5ClF5NO/c9-4-1-3(2-16)15-6(8(12,13)14)5(4)7(10)11/h1,7,16H,2H2
InChIKeyCEUVIRRGOJHMLW-UHFFFAOYSA-N
XLogP3.18
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.58
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,6-dichloro-3-(difluoromethyl)-2-(trifluoromethyl)pyridine
CID 118846674
[4-chloro-5-(difluoromethyl)-6-iodo-2-pyridinyl]methanol
CID 118845138
[4-(difluoromethyl)-5-methyl-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 118829480
[6-amino-3-(difluoromethyl)-2-(trifluoromethyl)-4-pyridinyl]methanol
CID 130107727
[2-(chloromethyl)-3-(difluoromethyl)-6-(trifluoromethyl)-4-pyridinyl]methanol
CID 118843740
4-(difluoromethyl)-6-(hydroxymethyl)-2-(trifluoromethyl)pyridine-3-carbonitrile
CID 133106992
[2-amino-3-(difluoromethyl)-6-(trifluoromethyl)-4-pyridinyl]methanol
CID 119014578
6-(aminomethyl)-3-(difluoromethyl)-2-(trifluoromethyl)pyridine-4-carbonyl chloride
CID 133084777
[4,6-dichloro-3-(difluoromethyl)-2-pyridinyl]methanol
CID 118806568
2-[2-chloro-3-(difluoromethyl)-6-(trifluoromethyl)-4-pyridinyl]acetic acid
CID 119019464
4-chloro-3-(difluoromethyl)-6-(trifluoromethyl)pyridine-2-carboxylic acid
CID 134674290
[3-(difluoromethyl)-6-fluoro-2-(trifluoromethyl)-4-pyridinyl]methanamine
CID 130081572

Frequently Asked Questions

What is the IUPAC name of [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol?
The IUPAC name of [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol (CID 118839527) is [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol.
What is the SMILES notation for [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol?
The canonical SMILES for [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol is OCc1cc(Cl)c(C(F)F)c(C(F)(F)F)n1.
What is the InChIKey of [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol?
The InChIKey is CEUVIRRGOJHMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5ClF5NO/c9-4-1-3(2-16)15-6(8(12,13)14)5(4)7(10)11/h1,7,16H,2H2.
What are the key properties of [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol?
[4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol has a molecular weight of 261.58 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)-2-pyridinyl]methanol is sourced from PubChem (CID 118839527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).