3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine

C8H3F8NO — CID 134680375

IUPAC3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
SMILESFCc1cc(OC(F)(F)F)c(F)c(C(F)(F)F)n1
InChIInChI=1S/C8H3F8NO/c9-2-3-1-4(18-8(14,15)16)5(10)6(17-3)7(11,12)13/h1H,2H2
InChIKeyKNIONSVKHFUWRI-UHFFFAOYSA-N
MW281.10 g/mol
LogP3.61
Rot. Bonds2

About 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine

3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine (PubChem CID 134680375) has the molecular formula C8H3F8NO and a molecular weight of 281.10 g/mol. Its IUPAC name is 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
PubChem CID134680375
Molecular FormulaC8H3F8NO
Molecular Weight281.10 g/mol
Exact Mass281.01
IUPAC Name3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
SMILESFCc1cc(OC(F)(F)F)c(F)c(C(F)(F)F)n1
InChIInChI=1S/C8H3F8NO/c9-2-3-1-4(18-8(14,15)16)5(10)6(17-3)7(11,12)13/h1H,2H2
InChIKeyKNIONSVKHFUWRI-UHFFFAOYSA-N
XLogP3.61
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.10
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-[5-fluoro-4-(trifluoromethoxy)-6-(trifluoromethyl)-2-pyridinyl]acetate
CID 134659768
[5,6-difluoro-4-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 130094281
[5-iodo-4-(trifluoromethoxy)-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 134677431
[5-fluoro-3-(trifluoromethoxy)-6-(trifluoromethyl)-2-pyridinyl]methanol
CID 134680686
2-(fluoromethyl)-3-methoxy-5-(trifluoromethoxy)-6-(trifluoromethyl)pyridine
CID 134669983
[2-fluoro-5-(trifluoromethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanol
CID 134662814
2-[2-amino-6-(fluoromethyl)-4-(trifluoromethoxy)-3-pyridinyl]acetic acid
CID 119003450
6-(bromomethyl)-2-fluoro-4-(trifluoromethoxy)-3-(trifluoromethyl)pyridine
CID 134680938
methyl 6-(chloromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine-3-carboxylate
CID 134673063
2-(fluoromethyl)-5-(trifluoromethoxy)pyridine-4-carbonitrile
CID 133095709
2-[4-methoxy-5-(trifluoromethoxy)-6-(trifluoromethyl)-2-pyridinyl]acetonitrile
CID 134682248
4-(difluoromethyl)-3-fluoro-6-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
CID 134665522

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine?
The IUPAC name of 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine (CID 134680375) is 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine?
The canonical SMILES for 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine is FCc1cc(OC(F)(F)F)c(F)c(C(F)(F)F)n1.
What is the InChIKey of 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine?
The InChIKey is KNIONSVKHFUWRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H3F8NO/c9-2-3-1-4(18-8(14,15)16)5(10)6(17-3)7(11,12)13/h1H,2H2.
What are the key properties of 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine?
3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine has a molecular weight of 281.10 g/mol, XLogP of 3.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-(fluoromethyl)-4-(trifluoromethoxy)-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 134680375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).