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Product No: AA6332

Ethyl 2-Aminothiazole-5-carboxylate, 97%

Name: Ethyl 2-Aminothiazole-5-carboxylate
Brand: Chempure
Rating: 4 (1 reviews)

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CAS Number

32955-21-8

Molecular Weight

172.2

Formula

C6H8N2O2S

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About this item

IUPAC name	ethyl 2-amino-1,3-thiazole-5-carboxylate
canonical smiles	CCOC(=O)C1=CN=C(S1)N
inchi	InChI=1S/C6H8N2O2S/c1-2-10-5(9)4-3-8-6(7)11-4/h3H,2H2,1H3,(H2,7,8)
inchi key	VNZXERIGKZNEKB-UHFFFAOYSA-N
molecular formula	C6H8N2O2S
synonyms	Ethyl 2-aminothiazole-5-carboxylate 32955-21-8 ethyl 2-amino-1,3-thiazole-5-carboxylate Ethyl 2-amino-thiazole-5-carboxylate 2-aminothiazole-5-carboxylic acid ethyl ester

Computed Properties

Molecular Weight:	172.21 g/mol
XLogP3:	1.2
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	5
Rotatable Bond Count:	3
Exact Mass:	172.03064868 g/mol
Monoisotopic Mass:	172.03064868 g/mol
Topological Polar Surface Area:	93.4 Å²
Heavy Atom Count:	11
Formal Charge:	0
Complexity:	154
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Ethylparaben

Aminorex

Diethylcarbamazine

2-Amino-5-Nitrothiazole

Zoxazolamine

Diloxanide

4-Methylaminorex

Ethyl N-piperazinecarboxylate

Ethyl 4-hydroxyphenylacetate

2-Amino-5,6-dichlorobenzothiazole

3-Acetylthiophene

Methyl 4-hydroxyphenylacetate

Methyl 6-aminonicotinate

5-(Trifluoromethyl)pyridin-2-amine

Ethyl 2-(2-aminothiazol-5-yl)acetate

hazard signal	Warning
hazard classes and categories	Acute Tox. 4 (20%) Skin Irrit. 2 (100%) Eye Irrit. 2 (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302+H312+H332 (20%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (20%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (20%): Harmful if inhaled [Warning Acute toxicity, inhalation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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About this item

Documentation

Certificate of Analysis

Lot Number

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CAS #

*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

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About this item

IUPAC name	ethyl 2-amino-1,3-thiazole-5-carboxylate
canonical smiles	CCOC(=O)C1=CN=C(S1)N
inchi	InChI=1S/C6H8N2O2S/c1-2-10-5(9)4-3-8-6(7)11-4/h3H,2H2,1H3,(H2,7,8)
inchi key	VNZXERIGKZNEKB-UHFFFAOYSA-N
molecular formula	C6H8N2O2S
synonyms	Ethyl 2-aminothiazole-5-carboxylate 32955-21-8 ethyl 2-amino-1,3-thiazole-5-carboxylate Ethyl 2-amino-thiazole-5-carboxylate 2-aminothiazole-5-carboxylic acid ethyl ester

Computed Properties

Molecular Weight:	172.21 g/mol
XLogP3:	1.2
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	5
Rotatable Bond Count:	3
Exact Mass:	172.03064868 g/mol
Monoisotopic Mass:	172.03064868 g/mol
Topological Polar Surface Area:	93.4 Å²
Heavy Atom Count:	11
Formal Charge:	0
Complexity:	154
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Ethylparaben

Aminorex

Diethylcarbamazine

2-Amino-5-Nitrothiazole

Zoxazolamine

Diloxanide

4-Methylaminorex

Ethyl N-piperazinecarboxylate

Ethyl 4-hydroxyphenylacetate

2-Amino-5,6-dichlorobenzothiazole

3-Acetylthiophene

Methyl 4-hydroxyphenylacetate

Methyl 6-aminonicotinate

5-(Trifluoromethyl)pyridin-2-amine

Ethyl 2-(2-aminothiazol-5-yl)acetate

hazard signal	Warning
hazard classes and categories	Acute Tox. 4 (20%) Skin Irrit. 2 (100%) Eye Irrit. 2 (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302+H312+H332 (20%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (20%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (20%): Harmful if inhaled [Warning Acute toxicity, inhalation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Product No: AA6332

Ethyl 2-Aminothiazole-5-carboxylate, 97%

Product No: AA6332

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: AA6332

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?