Pyridine hydrochloride - CAS 628-13-7

Name: Pyridine hydrochloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Technical Data

IUPAC Name:	pyridine;hydrochloride
Description:	Pyridine hydrochloride (CAS# 628-13-7) is the hydrochloride salt of pyridine, a basic six-membered heterocyclic ring. Pyridine is a base structure present in many biologically active compounds like the vitamins niacin and pyridoxal. Pyridine is used in dehalogenation reactions and can be used as a base in condensation reactions.
Molecular Weight:	115.56
Molecular Formula:	C5H5N · HCl
Canonical SMILES:	C1=CC=NC=C1.Cl
InChI:	InChI=1S/C5H5N.ClH/c1-2-4-6-5-3-1;/h1-5H;1H
InChI Key:	AOJFQRQNPXYVLM-UHFFFAOYSA-N
Boiling Point:	222-224 °C
Melting Point:	140-146 °C
Purity:	> 98.0 % (T)
Density:	1.34 g/cm³ (20 °C)
Appearance:	White to tan crystals
Storage:	Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Store protected from moisture.
MDL:	MFCD00012802
LogP:	1.88360

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021126729-A1	Prmt5 inhibitors	20191217
WO-2021115495-A1	Small-molecule sulfur-containing heterocyclic compound	20191212
WO-2021114802-A1	Preparation of tetradentate platinum(ii) complex and use thereof	20191211
WO-2021112189-A1	Curable resin composition, cured film, laminate, method for producing cured film, semiconductor device, and resin	20191205
WO-2021107024-A1	Curable resin composition, cured film, layered product, method for producing cured film, semiconductor device, and resin	20191127

PMID	Publication Date	Title	Journal
34528437	20211014	Indole Chloropyridinyl Ester-Derived SARS-CoV-2 3CLpro Inhibitors: Enzyme Inhibition, Antiviral Efficacy, Structure-Activity Relationship, and X-ray Structural Studies	Journal of medicinal chemistry
33049266	20201215	Teratogenesis in the chick embryo following post-gastrulation exposure to Y-27632 -effect of Y-27632 on embryonic development	Toxicology and applied pharmacology
31982400	20200201	Benzalkonium chloride and cetylpyridinium chloride induce apoptosis in human lung epithelial cells and alter surface activity of pulmonary surfactant monolayers	Chemico-biological interactions
31678113	20200105	Pyridine-2,3-dicarboxylate, quinolinic acid, induces 1N4R Tau amyloid aggregation in vitro: Another evidence for the detrimental effect of the inescapable endogenous neurotoxin	Chemico-biological interactions
30743094	20190401	Pyridine and nitro-phenyl linked 1,3,4-thiadiazoles as MDR-TB inhibitors	European journal of medicinal chemistry

Complexity:	30.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	115.0188769
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	115.0188769
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0