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Ethyl 2-Chloro-6-methylpyridine-4-carboxylate

Ethyl 2-Chloro-6-methylpyridine-4-carboxylate - CAS 3998-88-7

Name: Ethyl 2-Chloro-6-methylpyridine-4-carboxylate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024240
Product Name:	Ethyl 2-Chloro-6-methylpyridine-4-carboxylate
CAS:	3998-88-7
Synonyms:	2-chloro-6-methyl-4-pyridinecarboxylic acid ethyl ester; ethyl 2-chloro-6-methylpyridine-4-carboxylate

Technical Data

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Patents

Computed Properties

IUPAC Name:	ethyl 2-chloro-6-methylpyridine-4-carboxylate
Description:	Ethyl 2-Chloro-6-methylpyridine-4-carboxylate (CAS# 3998-88-7) is a useful research chemical.
Molecular Weight:	199.63
Molecular Formula:	C9H10ClNO2
Canonical SMILES:	CCOC(=O)C1=CC(=NC(=C1)Cl)C
InChI:	InChI=1S/C9H10ClNO2/c1-3-13-9(12)7-4-6(2)11-8(10)5-7/h4-5H,3H2,1-2H3
InChI Key:	UMAAIDIASQFLTF-UHFFFAOYSA-N
Boiling Point:	107 °C / 1.5 mmHg
Density:	1.207 g/cm³
MDL:	MFCD09842151
LogP:	2.22010

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[51493-02-8]C5H10ClNO
N-Methyl-N-propylcarbamoyl Chloride
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[91552-11-3]C10H9ClO2
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
AU-2018352142-A1	Imidazo-pyridine compounds as PAD inhibitors	20171018
CA-3076476-A1	Imidazo-pyridine compounds as pad inhibitors	20171018
CN-111225915-A	Imidazopyridine compounds as PAD inhibitors	20171018
WO-2019077631-A1	IMIDAZO-PYRIDINE COMPOUNDS FOR USE AS PAD INHIBITORS	20171018
EP-3697785-A1	Imidazo-pyridine compounds as pad inhibitors	20171018

Complexity:	187
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.0400063
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	199.0400063
Rotatable Bond Count:	3
Topological Polar Surface Area:	39.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4