AG00IIUD

952182-68-2 | 2-Piperidin-1-yl-1,3-thiazole-4-carboxylic acid

AG00IIUD

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CAS Number	952182-68-2
Catalog Number	AG00IIUD(AGN-PC-04HB58)
Chemical Name	2-Piperidin-1-yl-1,3-thiazole-4-carboxylic acid
IUPAC Name	2-piperidin-1-yl-1,3-thiazole-4-carboxylic acid
InChI	InChI=1S/C9H12N2O2S/c12-8(13)7-6-14-9(10-7)11-4-2-1-3-5-11/h6H,1-5H2,(H,12,13)
InChI Key	CTYVDXOBZLKERL-UHFFFAOYSA-N
MDL Number	MFCD09027189
Molecular Formula	C9H12N2O2S
Molecular Weight	212.2688
SMILES	OC(=O)C1=CSC(=N1)N1CCCCC1
Synonyms	952182-68-2, 2-(Piperidin-1-yl)thiazole-4-carboxylic acid, 2-Piperidino-1,3-thiazole-4-carboxylic acid, 2-(piperidin-1-yl)-1,3-thiazole-4-carboxylic acid, 2-Piperidin-1-yl-1,3-thiazole-4-carboxylic acid, piperidinothiazolecarboxylicacid, SCHEMBL3435678, CTK7J0765, DTXSID50640031, KS-000027LU, ANW-55458, MFCD09027189, SBB053151, ZINC12336804, AKOS005073450, MA-0720, MCULE-4202031015, MP-0300, RP12341, RTR-065231, AJ-61098, AK-64655, TR-065231, 2-piperidyl-1,3-thiazole-4-carboxylic acid, 4CH-009850, ST24027660, Z5397, J-506545, Z1741972926, C9H12N2O2S, 2-(Piperidin-1-yl)thiazole-4-carboxylicacid,

Complexity	219
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.062g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	212.267g/mol
Monoisotopic Mass	212.062g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	81.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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