CAS: 94695-50-8
名称: ethyl 3-oxo-3-(2,3,4,5-tetrafluorophenyl)propanoate
SMILES:
CCOC(=O)CC(=O)C1=CC(=C(C(=C1F)F)F)FMolecular Processing
Molecular formula
C11H8F4O3
Molecular weight
264.17
Exact mass
264.041
XLogP
2.38
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
51.85
Supplementary Information
InChIKey: KWDVJYLIAJHEOW-UHFFFAOYSA-N
同義語
EC 700-167-6Ethyl 3-oxo-(2,3,4,5-tetrafluorophenyl)propanoateethyl 2,3,4,5-tetrafluoro-beta-oxobenzenepropanoateRefChem:595039700-167-694695-50-8Ethyl 3-oxo-3-(2,3,4,5-tetrafluorophenyl)propanoateEthyl 2,3,4,5-tetrafluorobenzoylacetateEthyl (2,3,4,5-Tetrafluorobenzoyl)acetateethyl 3-(2,3,4,5-tetrafluorophenyl)-3-oxopropanoateMFCD005230202,3,4,5-Tetrafluorobenzoylacetic Acid Ethyl EsterEthyl (2345-Tetrafluorobenzoyl)acetateC11H8F4O3ethyl 3-oxo-3-(2,3,4,5-tetrafluorophenyl)propionate3-Oxo-3-(2,3,4,5-tetrafluorophenyl)propionic Acid Ethyl Ester(2,3,4,5-Tetrafluorobenzoyl)acetic Acid Ethyl Ester2,3,4,5-tetrafluorobenzoylacetic acid, ethyl esterSCHEMBL1185918SCHEMBL30958584DTXSID703449833-oxo-3-(2,3,4,5-tetrafluoro-phenyl)-propionic acid ethyl esterSBB102770AKOS015838707AC-7594FE60062AS-33243SY057196ethyl 2,3,4,5-tetrafluorobenzoyl-acetateDB-057522
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