2-aminothiazole-5-carboxylic acid - CAS 40283-46-3

Name: 2-aminothiazole-5-carboxylic acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024425
Product Name:	2-aminothiazole-5-carboxylic acid
CAS:	40283-46-3
Synonyms:	2-amino-5-thiazolecarboxylic acid; 2-amino-1,3-thiazole-5-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	2-amino-1,3-thiazole-5-carboxylic acid
Description:	2-aminothiazole-5-carboxylic acid (CAS# 40283-46-3) is a useful research chemical.
Molecular Weight:	144.15
Molecular Formula:	C4H4N2O2S
Canonical SMILES:	C1=C(SC(=N1)N)C(=O)O
InChI:	InChI=1S/C4H4N2O2S/c5-4-6-1-2(9-4)3(7)8/h1H,(H2,5,6)(H,7,8)
InChI Key:	ZFMRDDYYJJCBKC-UHFFFAOYSA-N
Boiling Point:	415 °C at 760 mmHg
Purity:	98 %
Density:	1.657 g/cm³
MDL:	MFCD06203554
LogP:	1.00470

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Related Functional Groups

Carbonyl Compounds

[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[59855-96-8]C6H7NO3S
2-(Methoxymethyl)thiazole-5-carboxylic Acid

GHS Hazard Statement:	H317 (95.12%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement:	P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-109265455-A	Preparation method of dasatinib	20181109
CN-107828247-B	One kind is suitable for anhydrous woolen dyed disperse dyes of supercritical carbon dioxide and preparation method thereof and colouring method with azo thiazole structure	20171020
KR-20200052936-A	Heteroaryl substituted beta-hydroxyethylamine for use in the treatment of hyperglycemia	20170913
BR-112020005113-A2	beta-hydroxyethylamines substituted by heteroaryl for use in the treatment of hyperglycemia	20170913
CN-111315726-A	Heteroaryl substituted Î² -hydroxyethylamines for the treatment of hyperglycemia	20170913

PMID	Publication Date	Title	Journal
22412626	20120301	Ethyl 2-[(tert-but-oxy-carbon-yl)amino]-thia-zole-5-carboxyl-ate	Acta crystallographica. Section E, Structure reports online
21588688	20100818	Methyl 2-(tert-but-oxy-carbonyl-amino)-1,3-thia-zole-5-carboxyl-ate	Acta crystallographica. Section E, Structure reports online
19440303	20090101	Identification of 2-aminothiazole-4-carboxylate derivatives active against Mycobacterium tuberculosis H37Rv and the beta-ketoacyl-ACP synthase mtFabH	PloS one

Complexity:	130
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	143.99934855
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	143.99934855
Rotatable Bond Count:	1
Topological Polar Surface Area:	104 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5