AG006TWK

52454-66-7 | 2-(2-Aminothiazol-5-yl)acetic acid

AG006TWK

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CAS Number	52454-66-7
Catalog Number	AG006TWK(AGN-PC-0JLE6X)
Chemical Name	2-(2-Aminothiazol-5-yl)acetic acid
EC Number	257-929-1
IUPAC Name	2-(2-amino-1,3-thiazol-5-yl)acetic acid
InChI	InChI=1S/C5H6N2O2S/c6-5-7-2-3(10-5)1-4(8)9/h2H,1H2,(H2,6,7)(H,8,9)
InChI Key	APIMXAGCLCGUGB-UHFFFAOYSA-N
MDL Number	MFCD09754165
Molecular Formula	C5H6N2O2S
Molecular Weight	158.1783
SMILES	NC1SC(CC(O)=O)=CN=1
Synonyms	52454-66-7, 2-(2-Aminothiazol-5-yl)acetic acid, 2-(2-amino-1,3-thiazol-5-yl)acetic acid, 2-Aminothiazol-5-acetic acid, 2-Aminothiazole-5-acetic acid, 2-amino-5-thiazoleacetic acid, 5-thiazoleacetic acid, 2-amino-, EINECS 257-929-1, 2-AMINO-THIAZOLE-5-ACETIC ACID, AC1L2WBF, AC1Q5VKK, CHEMBL71361, SCHEMBL3255716, 2-amino-5-carboxymethylthiazole, 5-Thiazoleacetic acid,2-amino-, CTK4J5936, DTXSID10200453, APIMXAGCLCGUGB-UHFFFAOYSA-N, KS-000007OM, ZINC5161639, MFCD09754165, AKOS000747732, MCULE-1412802881, PB16173, AJ-53394, AS-34768, SC-21218, SY111841, (2-AMINO-THIAZOL-5-YL)-ACETIC ACID, CS-0052306, MFCD09754165 (95%), Q-2453, J-507972, I14-16072, 2-aminothiazol-5-aceticacid, C5-H6-N2-O2-S, AR-1G9560, CID104197, 5342-70-1,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.015g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	158.175g/mol
Monoisotopic Mass	158.015g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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