Ethyl 2,6-Dichloropyrimidine-4-carboxylate - CAS 18127-43-0

Catalog:	BB013800
Product Name:	Ethyl 2,6-Dichloropyrimidine-4-carboxylate
CAS:	18127-43-0
Synonyms:	2,6-dichloro-4-pyrimidinecarboxylic acid ethyl ester; ethyl 2,6-dichloropyrimidine-4-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 2,6-dichloropyrimidine-4-carboxylate
Description:	Ethyl 2,6-Dichloropyrimidine-4-carboxylate (CAS# 18127-43-0 ) is a useful research chemical.
Molecular Weight:	221.04
Molecular Formula:	C7H6Cl2N2O2
Canonical SMILES:	CCOC(=O)C1=CC(=NC(=N1)Cl)Cl
InChI:	InChI=1S/C7H6Cl2N2O2/c1-2-13-6(12)4-3-5(8)11-7(9)10-4/h3H,2H2,1H3
InChI Key:	YPXGMTVJJQHIMB-UHFFFAOYSA-N
Boiling Point:	318 °C at 760 mmHg
Density:	1.433 g/cm³
LogP:	1.96010

Publication Number	Title	Priority Date
WO-2021152149-A1	Ras inhibitors and methods of using the same	20200131
CA-2921881-A1	Alkynyl alcohols and methods of use	20130822
EP-3036229-A1	Alkynyl alcohols and methods of use	20130822
JP-2016531127-A	Alkynyl alcohol and method of use	20130822
TW-201542520-A	Alkynyl alcohol and method of use thereof	20130822

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate

Complexity:	191
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	219.9806328
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	219.9806328
Rotatable Bond Count:	3
Topological Polar Surface Area:	52.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.7