Methyl 5-Hydroxy-2-pyridinecarboxylate - CAS 30766-12-2

Catalog:	BB020719
Product Name:	Methyl 5-Hydroxy-2-pyridinecarboxylate
CAS:	30766-12-2
Synonyms:	5-hydroxy-2-pyridinecarboxylic acid methyl ester; methyl 5-hydroxypyridine-2-carboxylate

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Computed Properties

IUPAC Name:	methyl 5-hydroxypyridine-2-carboxylate
Description:	Methyl 5-Hydroxy-2-pyridinecarboxylate (CAS# 30766-12-2) is a useful research chemical.
Molecular Weight:	153.14
Molecular Formula:	C7H7NO3
Canonical SMILES:	COC(=O)C1=NC=C(C=C1)O
InChI:	InChI=1S/C7H7NO3/c1-11-7(10)6-3-2-5(9)4-8-6/h2-4,9H,1H3
InChI Key:	YYAYXDDHGPXWTA-UHFFFAOYSA-N
Boiling Point:	374.2 °C at 760 mmHg
Density:	1.287 g/cm³
Appearance:	White to off white solid
MDL:	MFCD05256426
LogP:	0.57380

Publication Number	Title	Priority Date
CN-111146496-B	Polymer electrolyte and lithium ion battery containing same	20191223
US-2021196710-A1	Compounds and methods for the targeted degradation of androgen receptor	20191219
WO-2021127443-A1	Compounds and methods for the targeted degradation of androgen receptor	20191219
CN-112979655-A	Triazolopyridazine derivative, preparation method, pharmaceutical composition and application thereof	20191216
WO-2021121294-A1	Triazolopyridazine derivative, preparation method therefor, pharmaceutical composition thereof, and use thereof	20191216

PMID	Publication Date	Title	Journal
20681301	20100301	[Studies on the chemical constituents from aerial parts of Gynura divaricata]	Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning 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, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	149
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	153.042593085
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	153.042593085
Rotatable Bond Count:	2
Topological Polar Surface Area:	59.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0