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4-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-2-methyl-3-butyn-2-ol

HCID 1474401
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Basic information

CAS
865657-83-6
Standard SMILES
CC(C)(O)C#Cc1ncc(C(F)(F)F)cc1Cl
InChIKey
QXNOBAYVAIGEDZ-UHFFFAOYSA-N
Molecular formula
C11H9ClF3NO
Average molar mass
263.646 g/mol
Monoisotopic mass
263.03247625

Names & identifiers

Preferred name
4-[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]-2-methyl-3-butyn-2-ol
IUPAC
4-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-2-methylbut-3-yn-2-ol
English name
4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-METHYL-3-BUTYN-2-OL
Molecular formula
C11H9ClF3NO
Molecular weight
263.64

Names & synonyms

4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-methylbut-3-yn-2-ol4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-METHYL-3-BUTYN-2-OL3-Butyn-2-ol, 4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-methyl-

Database identifiers

CAS
865657-83-6
PubChem CID
1474401
DTXSID
DTXSID401165011
ChEMBL
CHEMBL1717857

Properties

Physicochemical properties

Boiling point
298.7 · 298.7±40.0 °C(Predicted)
Density
1.39 · 1.39±0.1 g/cm3(Predicted)
pka
13.13 · 13.13±0.29(Predicted)

Chemistry & industry

Suppliers3 total

Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]

Related reactions

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Compound notes

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