4,6-Dichloro-2-(2-pyridyl)pyrimidine - CAS 10235-65-1

Catalog:	BB000840
Product Name:	4,6-Dichloro-2-(2-pyridyl)pyrimidine
CAS:	10235-65-1
Synonyms:	4,6-dichloro-2-(2-pyridinyl)pyrimidine; 4,6-dichloro-2-pyridin-2-ylpyrimidine

Technical Data

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Computed Properties

IUPAC Name:	4,6-dichloro-2-pyridin-2-ylpyrimidine
Description:	4,6-Dichloro-2-(2-pyridyl)pyrimidine (CAS# 10235-65-1) is a useful research chemical.
Molecular Weight:	226.06
Molecular Formula:	C9H5Cl2N3
Canonical SMILES:	C1=CC=NC(=C1)C2=NC(=CC(=N2)Cl)Cl
InChI:	InChI=1S/C9H5Cl2N3/c10-7-5-8(11)14-9(13-7)6-3-1-2-4-12-6/h1-5H
InChI Key:	NBAPGMJZRHWJAA-UHFFFAOYSA-N
Boiling Point:	254.534 °C at 760 mmHg
Density:	1.428 g/cm³
Storage:	Inert atmosphere, 2-8 °C
LogP:	2.84540

Publication Number	Title	Priority Date
EP-3019483-B1	Therapeutically active compounds and their methods of use	20130711
US-10028961-B2	Therapeutically active compounds and their methods of use	20130711
US-10172864-B2	Therapeutically active compounds and their methods of use	20130711
US-2015018328-A1	Therapeutically active compounds and their methods of use	20130711
US-2016220572-A1	Therapeutically active compounds and their methods of use	20130711

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

Complexity:	181
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	224.9860526
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	224.9860526
Rotatable Bond Count:	1
Topological Polar Surface Area:	38.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8