3-Methyl-2-(trifluoromethyl)pyridine - CAS 1620-78-6

Catalog:	BB011830
Product Name:	3-Methyl-2-(trifluoromethyl)pyridine
CAS:	1620-78-6
Synonyms:	3-methyl-2-(trifluoromethyl)pyridine; 3-methyl-2-(trifluoromethyl)pyridine

Technical Data

Patents

Computed Properties

IUPAC Name:	3-methyl-2-(trifluoromethyl)pyridine
Description:	3-Methyl-2-(trifluoromethyl)pyridine (CAS# 1620-78-6) is a useful research chemical.
Molecular Weight:	161.12
Molecular Formula:	C7H6F3N
Canonical SMILES:	CC1=C(N=CC=C1)C(F)(F)F
InChI:	InChI=1S/C7H6F3N/c1-5-3-2-4-11-6(5)7(8,9)10/h2-4H,1H3
InChI Key:	AOYVIESJJAWOAM-UHFFFAOYSA-N
Boiling Point:	143.1 °C at 760 mmHg
Density:	1.216 g/cm³
MDL:	MFCD07774129
LogP:	2.40880

Publication Number	Title	Priority Date
US-2021177856-A1	Use of atr inhibitors in combination with parp inhibitors	20191211
WO-2021119523-A1	Use of atr inhibitors in combination with parp inhibitors	20191211
WO-2021115286-A1	Six-membered and five-membered aromatic ring derivative containing nitrogen heteroatoms which can be used as shp2 inhibitor	20191210
WO-2021102288-A1	Pyridopyrimidinone derivatives as ahr antagonists	20191122
WO-2021097039-A1	Triazole carbamate pyridyl sulfonamides as lpa receptor antagonists and uses thereof	20191115

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Related Functional Groups

Pyridines

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2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide
[1261365-99-4]
2,5-Dichloro-6-(hydroxymethyl)pyridin-3-ol
[4926-28-7]
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[7356-60-7]
3-Amidinopyridine Hydrochloride

Complexity:	132
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	161.04523368
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	161.04523368
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1