5-Bromo-2-methoxy-3-pyridinemethanol - CAS 351410-47-4

Catalog:	BB022496
Product Name:	5-Bromo-2-methoxy-3-pyridinemethanol
CAS:	351410-47-4
Synonyms:	(5-bromo-2-methoxy-3-pyridinyl)methanol; (5-bromo-2-methoxypyridin-3-yl)methanol

Technical Data

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Computed Properties

IUPAC Name:	(5-bromo-2-methoxypyridin-3-yl)methanol
Description:	5-Bromo-2-methoxy-3-pyridinemethanol (CAS# 351410-47-4) is a useful research chemical.
Molecular Weight:	218.05
Molecular Formula:	C7H8BrNO2
Canonical SMILES:	COC1=NC=C(C=C1CO)Br
InChI:	InChI=1S/C7H8BrNO2/c1-11-7-5(4-10)2-6(8)3-9-7/h2-3,10H,4H2,1H3
InChI Key:	PQCNLQJWEVAXSY-UHFFFAOYSA-N
MDL:	MFCD11840327
LogP:	1.34500

Publication Number	Title	Priority Date
US-2020392154-A1	Pyridine carbamates and their use as glun2b receptor modulators	20190614
WO-2020249799-A1	Pyridine carbamates and their use as glun2b receptor modulators	20190614
WO-2020236692-A1	Pyridinone derivatives as selective cytotoxic agents against hiv infected cells	20190522
AU-2017339249-A1	Substituted pyrrolidines and their use in the treatment of cystic fiibrosis	20161007
AU-2017339839-A1	Substituted pyrrolidines as CFTR modulators	20161007

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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]; 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	123
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	216.97384
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	216.97384
Rotatable Bond Count:	2
Topological Polar Surface Area:	42.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1