Ethyl Thiazole-5-carboxylate - CAS 32955-22-9

Catalog:	BB021491
Product Name:	Ethyl Thiazole-5-carboxylate
CAS:	32955-22-9
Synonyms:	5-thiazolecarboxylic acid ethyl ester; ethyl 1,3-thiazole-5-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 1,3-thiazole-5-carboxylate
Description:	Ethyl Thiazole-5-carboxylate (CAS# 32955-22-9) is a useful research chemical.
Molecular Weight:	157.19
Molecular Formula:	C6H7NO2S
Canonical SMILES:	CCOC(=O)C1=CN=CS1
InChI:	InChI=1S/C6H7NO2S/c1-2-9-6(8)5-3-7-4-10-5/h3-4H,2H2,1H3
InChI Key:	CIPMPQGRFNDLAP-UHFFFAOYSA-N
Boiling Point:	235.7 °C at 760 mmHg
Density:	1.242 g/cm³
MDL:	MFCD06205069
LogP:	1.31980

Publication Number	Title	Priority Date
CN-111848546-A	2- (aminomethyl) thiazole-5-nitrile and synthesis method thereof	20200803
CN-113024534-A	2-pyridylthiazole derivatives and use thereof	20191224
WO-2021107125-A1	Compound having lysophosphatidic acid receptor agonistic activity and pharmaceutical use of said compound	20191129
WO-2021069705-A1	Isoindolinone compounds	20191009
CN-111004228-A	GSK-3 Î²/ChE dual inhibitor and preparation method and application thereof	20190910

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Complexity:	129
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	157.01974964
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	157.01974964
Rotatable Bond Count:	3
Topological Polar Surface Area:	67.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5