2-Amino-3-fluoro-6-methylpyridine - CAS 1211520-83-0

Catalog:	BB005056
Product Name:	2-Amino-3-fluoro-6-methylpyridine
CAS:	1211520-83-0
Synonyms:	3-fluoro-6-methyl-2-pyridinamine; 3-fluoro-6-methylpyridin-2-amine

Technical Data

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Computed Properties

IUPAC Name:	3-fluoro-6-methylpyridin-2-amine
Description:	2-Amino-3-fluoro-6-methylpyridine (CAS# 1211520-83-0) is a useful research chemical.
Molecular Weight:	126.13
Molecular Formula:	C6H7FN2
Canonical SMILES:	CC1=NC(=C(C=C1)F)N
InChI:	InChI=1S/C6H7FN2/c1-4-2-3-5(7)6(8)9-4/h2-3H,1H3,(H2,8,9)
InChI Key:	FPJIQRVLVUQHFL-UHFFFAOYSA-N
LogP:	1.69250

Publication Number	Title	Priority Date
WO-2021191379-A1	5-amino-8-(4-pyridyl)-[1,2,4]triazolo[4,3-c]pyrimidin-3-one compounds for use against cancer	20200326
WO-2021070132-A1	Bi-aryl dihydroorotate dehydrogenase inhibitors	20191010
WO-2020232401-A1	Combination therapies with ire1 small molecule inhibitors	20190515
WO-2020232403-A1	Treatment of fibrosis with ire1 small molecule inhibitors	20190515
WO-2020144638-A1	Dihydroorotate dehydrogenase inhibitors	20190111

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	97.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	126.05932639
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	126.05932639
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1