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2-Chloro-4-(4-methoxyphenyl)pyrimidine

2-Chloro-4-(4-methoxyphenyl)pyrimidine - CAS 75634-04-7

Catalog:	BB035358
Product Name:	2-Chloro-4-(4-methoxyphenyl)pyrimidine
CAS:	75634-04-7
Synonyms:	2-chloro-4-(4-methoxyphenyl)pyrimidine; 2-chloro-4-(4-methoxyphenyl)pyrimidine

Technical Data

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Computed Properties

IUPAC Name:	2-chloro-4-(4-methoxyphenyl)pyrimidine
Description:	2-Chloro-4-(4-methoxyphenyl)pyrimidine (CAS# 75634-04-7 ) is a useful research chemical.
Molecular Weight:	220.65
Molecular Formula:	C11H9ClN2O
Canonical SMILES:	COC1=CC=C(C=C1)C2=NC(=NC=C2)Cl
InChI:	InChI=1S/C11H9ClN2O/c1-15-9-4-2-8(3-5-9)10-6-7-13-11(12)14-10/h2-7H,1H3
InChI Key:	TZERORVMIAWOMA-UHFFFAOYSA-N
Boiling Point:	401.6 °C at 760 mmHg
Density:	1.245 g/cm³
LogP:	2.80560

Publication Number	Title	Priority Date
KR-20180082432-A	Bicyclic compound and its use for inhibiting SUV39H2	20150929
KR-101452235-B1	Novel pyrimidine derivatives or pharmaceutically acceptable salts thereof, process for the preparation thereof and pharmaceutical composition for prevention or treatment of RAGE receptor related diseases containing the same as an active ingredient	20120203
KR-20130090144-A	Novel pyrimidine derivatives or pharmaceutically acceptable salts thereof, preparation methods thereof, and pharmaceutical compositions for the prevention or treatment of RAE receptor-related diseases comprising the same	20120203
US-2013184284-A1	Diaminocyclohexane compounds and uses thereof	20110718
US-8815909-B2	Diaminocyclohexane compounds and uses thereof	20110718

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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:	195
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	220.0403406
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	220.0403406
Rotatable Bond Count:	2
Topological Polar Surface Area:	35
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8