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Methyl 2-Amino-4-methylthiazole-5-carboxylate

Methyl 2-Amino-4-methylthiazole-5-carboxylate - CAS 3829-80-9

Catalog:	BB023614
Product Name:	Methyl 2-Amino-4-methylthiazole-5-carboxylate
CAS:	3829-80-9
Synonyms:	2-amino-4-methyl-5-thiazolecarboxylic acid methyl ester; methyl 2-amino-4-methyl-1,3-thiazole-5-carboxylate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	methyl 2-amino-4-methyl-1,3-thiazole-5-carboxylate
Description:	Methyl 2-Amino-4-methylthiazole-5-carboxylate (CAS# 3829-80-9) is a useful research chemical.
Molecular Weight:	172.20
Molecular Formula:	C6H8N2O2S
Canonical SMILES:	CC1=C(SC(=N1)N)C(=O)OC
InChI:	InChI=1S/C6H8N2O2S/c1-3-4(5(9)10-2)11-6(7)8-3/h1-2H3,(H2,7,8)
InChI Key:	TYUGYIMCRDPMPJ-UHFFFAOYSA-N
Boiling Point:	301.3 °C at 760 mmHg
Density:	1.339 g/cm³
LogP:	1.40150

Publication Number	Title	Priority Date
WO-2021163192-A1	Myc inhibitors and uses thereof	20200210
WO-2019126353-A2	Compositions and methods for the treatment of bacterial infections	20171220
CN-106632134-B	2- (4-thiazolinone-2-imino) thiazole-5-carboxylic ester and preparation method and application thereof	20151104
CN-102079732-A	Method for synthesizing 2-amino-4-methylthiazole-5-carboxylate and derivatives thereof	20110127
CN-102079732-B	Method for synthesizing 2-amino-4-methylthiazole-5-carboxylate and derivatives thereof	20110127

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Related Functional Groups

Carbonyl Compounds

[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
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[2168559-63-3]
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride

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

Complexity:	165
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	172.03064868
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	172.03064868
Rotatable Bond Count:	2
Topological Polar Surface Area:	93.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2