3-Hydroxy-2,6-dimethylpyridine - CAS 1122-43-6

Catalog:	BB002906
Product Name:	3-Hydroxy-2,6-dimethylpyridine
CAS:	1122-43-6
Synonyms:	2,6-dimethyl-3-pyridinol; 2,6-dimethylpyridin-3-ol

Technical Data

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Computed Properties

IUPAC Name:	2,6-dimethylpyridin-3-ol
Description:	3-Hydroxy-2,6-dimethylpyridine (CAS# 1122-43-6) is a useful research chemical.
Molecular Weight:	123.15
Molecular Formula:	C7H9NO
Canonical SMILES:	CC1=NC(=C(C=C1)O)C
InChI:	InChI=1S/C7H9NO/c1-5-3-4-7(9)6(2)8-5/h3-4,9H,1-2H3
InChI Key:	AMQJAKKATFMFTR-UHFFFAOYSA-N
Boiling Point:	278.9 °C at 760 mmHg
Density:	1.083 g/cm³
Storage:	Inert atmosphere, Room Temperature
LogP:	1.40400

Publication Number	Title	Priority Date
WO-2020139636-A1	(pyridin-2-yl)amine derivatives as tgf-beta r1 (alk5) inhibitors for the treatment of cancer	20181227
CN-113348167-A	(pyridin-2-yl) amine derivatives as TGF-beta R1(ALK5) inhibitors for the treatment of cancer	20181227
KR-20210110316-A	(pyridin-2-yl)amine derivatives as TGF-beta R1 (ALK5) inhibitors for the treatment of cancer	20181227
AU-2018358346-A1	Modulators of the integrated stress pathway	20171102
CA-3080801-A1	Modulators of the integrated stress pathway	20171102

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	94.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	123.068413911
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	123.068413911
Rotatable Bond Count:	0
Topological Polar Surface Area:	33.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3