CCOC=C(C(=O)C1=C(C(=C(C=C1F)F)F)C)C(=O)OCC
الاسم: ethyl 3-ethoxy-2-(3,4,6-trifluoro-2-methylbenzoyl)prop-2-enoate
SMILES: CCOC=C(C(=O)C1=C(C(=C(C=C1F)F)F)C)C(=O)OCC

Molecular Processing

Molecular formula
C15H15F3O4
Molecular weight
316.28
Exact mass
316.0922
XLogP
3.08
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
22
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
0.333
Molar refractivity
71.73

Supplementary Information

InChIKey: QRGOUUQQSHGGKE-UHFFFAOYSA-N
مرادفات
SCHEMBL5504513QRGOUUQQSHGGKE-UHFFFAOYSA-Nethyl 2-(2,4,5-trifluoro-6-methylbenzoyl)-3-ethoxyacrylateethyl 2-(2-methyl-3,4,6-trifluorobenzoyl)-3-ethoxyacrylate
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