4,6-Dichloropyridine-3-methanol - CAS 73998-95-5

Catalog:	BB034970
Product Name:	4,6-Dichloropyridine-3-methanol
CAS:	73998-95-5
Synonyms:	(4,6-dichloro-3-pyridinyl)methanol; (4,6-dichloropyridin-3-yl)methanol

Technical Data

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Computed Properties

IUPAC Name:	(4,6-dichloropyridin-3-yl)methanol
Description:	4,6-Dichloropyridine-3-methanol (CAS# 73998-95-5) is a useful research chemical.
Molecular Weight:	178.02
Molecular Formula:	C6H5Cl2NO
Canonical SMILES:	C1=C(C(=CN=C1Cl)CO)Cl
InChI:	InChI=1S/C6H5Cl2NO/c7-5-1-6(8)9-2-4(5)3-10/h1-2,10H,3H2
InChI Key:	VDXWCRIARMBDOX-UHFFFAOYSA-N
Boiling Point:	298.4 °C at 760 mmHg
Density:	1.478 g/cm³
MDL:	MFCD04114262
LogP:	1.88070

Publication Number	Title	Priority Date
US-2021070731-A1	Tricyclic kinase inhibitors and use thereof	20190905
WO-2020033707-A1	Carboxamides as ubiquitin-specific protease inhibitors	20180809
AU-2019319907-A1	Carboxamides as ubiquitin-specific protease inhibitors	20180809
CN-112867712-A	Carboxamides as ubiquitin-specific protease inhibitors	20180809
EP-3833661-A1	Carboxamides as ubiquitin-specific protease inhibitors	20180809

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Related Functional Groups

Pyridines

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[1951441-75-0]
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[14993-80-7]
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[104496-91-5]
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[856848-33-4]
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[7356-60-7]
3-Amidinopyridine Hydrochloride

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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:	112
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	176.9748192
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	176.9748192
Rotatable Bond Count:	1
Topological Polar Surface Area:	33.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6