3-Hydroxy-5-methylpyridine - CAS 42732-49-0

Catalog:	BB025212
Product Name:	3-Hydroxy-5-methylpyridine
CAS:	42732-49-0
Synonyms:	5-methyl-3-pyridinol; 5-methylpyridin-3-ol

Technical Data

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Patents

Computed Properties

IUPAC Name:	5-methylpyridin-3-ol
Description:	3-Hydroxy-5-methylpyridine (CAS# 42732-49-0) is metabolite from the halotolerant fungal strain Wallemia sebi PXP-89.
Molecular Weight:	109.13
Molecular Formula:	C6H7NO
Canonical SMILES:	CC1=CC(=CN=C1)O
InChI:	InChI=1S/C6H7NO/c1-5-2-6(8)4-7-3-5/h2-4,8H,1H3
InChI Key:	RYJNCIGFPWGVPA-UHFFFAOYSA-N
Boiling Point:	317.3 °C at 760 mmHg
Density:	1.12 g/cm³
Solubility:	Slightly soluble in water.
Appearance:	Pale yellow powder
MDL:	MFCD00661297
LogP:	1.09560

Publication Number	Title	Priority Date
CN-111983111-A	Method for measuring retention rate of cigarette filter stick on hydroxypyridine	20200904
CN-113122053-A	Quantum dot ink and preparation method of quantum dot film	20191230
WO-2021094312-A1	Pyrrolidine and bicycloheteroaryl containing oga inhibitor compounds	20191111
CN-111377917-A	Heterocyclic compound, intermediate, preparation method and application thereof	20181229
WO-2020135771-A1	Heterocyclic compound intermediate, preparation method therefor and application thereof	20181229

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	74.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	109.052763847
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	109.052763847
Rotatable Bond Count:	0
Topological Polar Surface Area:	33.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9