AG001F9M

1479-24-9 | Benzenepropanoic acid, 2-fluoro-β-oxo-, ethyl ester

AG001F9M

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CAS Number	1479-24-9
Catalog Number	AG001F9M(AGN-PC-0Q13KP)
Chemical Name	Benzenepropanoic acid, 2-fluoro-β-oxo-, ethyl ester
IUPAC Name	ethyl 3-(2-fluorophenyl)-3-oxopropanoate
InChI	InChI=1S/C11H11FO3/c1-2-15-11(14)7-10(13)8-5-3-4-6-9(8)12/h3-6H,2,7H2,1H3
InChI Key	YMUNUVJSNWUWDA-UHFFFAOYSA-N
MDL Number	MFCD00000321
Molecular Formula	C11H11FO3
Molecular Weight	210.2016
NSC Number	166423
SMILES	C(=O)(CC(=O)OCC)c1c(F)cccc1
Synonyms	1479-24-9, ethyl 3-(2-fluorophenyl)-3-oxopropanoate, Ethyl (2-fluorobenzoyl)acetate, Ethyl 3-(2-fluorophenyl)-3-oxo-propionate, 3-(2-Fluoro-Phenyl)-3-Oxo-Propionic Acid Ethyl Ester, Benzenepropanoic acid, 2-fluoro-beta-oxo-, ethyl ester, AK-29881, ethyl 3-(2-fluorophenyl)-3-oxopropionate, 3-(2-fluorophenyl)-3-oxopropionic acid ethyl ester, NSC166423, AC1L6PZL, ACMC-1C1ES, AC1Q34NC, ethyl 2-fluorobenzoylacetate, ethyl-2-fluorobenzoylacetate, SCHEMBL312900, CTK4C5627, ethyl 2-(2-flurobenzoyl)acetate, KS-00001KJI, DTXSID40304594, YMUNUVJSNWUWDA-UHFFFAOYSA-N, AM756, ZINC6594575, 7365AA, AB2842, MFCD00000321, 2-Fluorobenzoylacetic acid ethyl ester, AKOS009156902, MCULE-7824402334, NSC-166423, TRA0025178, (2-Fluorobenzoyl)acetic Acid Ethyl Ester, AJ-56406, AS-44662, AX8027570, DB-063740, TX-018226, CS-0045387, E1097, FT-0647637, ST51038072, Ethyl (2-fluorobenzoyl)acetate, technical grade, 479F249, Benzenepropanoic acid,2-fluoro-b-oxo-,ethyl ester, Benzenepropanoic acid,2-fluoro-b-oxo-, ethyl ester, J-008426, I14-54280, C11H11FO3, CID296342,

Complexity	240
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.069g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	210.204g/mol
Monoisotopic Mass	210.069g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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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