AG00EAT6

6283-81-4 | 3-OXO-3-PYRIDIN-3-YL-PROPIONIC ACID ETHYL ESTER

AG00EAT6

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CAS Number	6283-81-4
Catalog Number	AG00EAT6(AGN-PC-0T66UZ)
Chemical Name	3-OXO-3-PYRIDIN-3-YL-PROPIONIC ACID ETHYL ESTER
IUPAC Name	ethyl 3-oxo-3-pyridin-3-ylpropanoate
InChI	InChI=1S/C10H11NO3/c1-2-14-10(13)6-9(12)8-4-3-5-11-7-8/h3-5,7H,2,6H2,1H3
InChI Key	APQGYFNHIWMRIJ-UHFFFAOYSA-N
MDL Number	MFCD00160418
Molecular Formula	C10H11NO3
Molecular Weight	193.1992
SMILES	O=C(OCC)CC(C1=CC=CN=C1)=O
Synonyms	6283-81-4, ethyl 3-oxo-3-(pyridin-3-yl)propanoate, 3-Oxo-3-pyridin-3-yl-propionic acid ethyl ester, ETHYL 3-OXO-3-(3-PYRIDYL)PROPIONATE, ETHYL NICOTINOYLACETATE, ethyl 3-oxo-3-pyridin-3-ylpropanoate, APQGYFNHIWMRIJ-UHFFFAOYSA-N, 3-OXO-3-(PYRIDIN-3-YL)-PROPANOIC ACID ETHYL ESTER, NSC7725, AC1L5BG5, SCHEMBL81386, CHEMBL2035666, CTK5B6293, KS-00001KJV, DTXSID20278486, ALBB-006289, Ethyl-2-(3-pyridylcarbonyl)acetate, NSC-7725, NSC32400, ZINC1688320, ANW-46688, ethyl beta-oxo-3-pyridine propionate, MFCD00160418, NSC-32400, STK503808, AKOS000265391, MCULE-9876818394, PB14133, AJ-29929, AS-18455, CJ-27964, SC-40668, Ethyl 3-oxo-3-(3-pyridinyl)propanoate #, ST2406930, TX-010461, BB 0216398, CS-0054614, FT-0677911, W7481, 3-Pyridinepropanoicacid, b-oxo-, ethyl ester, 3-(3-pyridyl)-3-oxopropionic acid ethyl ester, 3-Pyridinepropanoic acid, 3-oxo-, ethyl ester, ETHYL 3-OXO-3-(3-PYRIDINYL)PROPIONATE, Q-1165, Pyridin-3-propionic acid, 3-oxo-, ethyl(ester), 283O814, 3-Pyridinepropanoic acid, beta-oxo-, ethyl ester, 3-Pyridinepropanoic acid, .beta.-oxo-, ethyl ester, I04-4093, Z56943465, C10H11NO3, CID222197, 3-OXO-3-PYRIDIN-3-YL-PROPIONICACIDETHYLESTER, 90922-54-6,

Complexity	215
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	193.074g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	193.202g/mol
Monoisotopic Mass	193.074g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	56.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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