AG00GSYA

887572-34-1 | 6-Chloro-4-ethoxynicotinic acid

AG00GSYA

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CAS Number	887572-34-1
Catalog Number	AG00GSYA(AGN-PC-0JWI98)
Chemical Name	6-Chloro-4-ethoxynicotinic acid
IUPAC Name	6-chloro-4-ethoxypyridine-3-carboxylic acid
InChI	InChI=1S/C8H8ClNO3/c1-2-13-6-3-7(9)10-4-5(6)8(11)12/h3-4H,2H2,1H3,(H,11,12)
InChI Key	KCYIQGBNKNCDNM-UHFFFAOYSA-N
MDL Number	MFCD00834973
Molecular Formula	C8H8ClNO3
Molecular Weight	201.6070
SMILES	O=C(O)C1=CN=C(Cl)C=C1OCC
Synonyms	6-chloro-4-ethoxynicotinic acid, 887572-34-1, 6-chloro-4-ethoxypyridine-3-carboxylic acid, AC-907/34126044, AC1LG9VR, SCHEMBL7866700, CTK6G1233, DTXSID90355859, 6-Chloro-4-ethoxy-nicotinic acid, ZINC332013, ANW-60830, MFCD00834973, SBB092818, AKOS015851213, FCH1332056, QC-1624, RP04325, AJ-19514, AK-79322, AS-40827, AX8168083, TR-039328, 6-Chloro-4-ethoxy-3-pyridinecarboxylic acid, ST24045287, Y5638, A-7292, J-518563, C8H8ClNO3, 6-Chloro-4-ethoxynicotinicacid, CID817775, 6-Chloro-4-ethoxynicotinic acid, 97% - 1G 1g,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	201.019g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	201.606g/mol
Monoisotopic Mass	201.019g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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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