CCOC(=O)C(F)(F)Cc1ccc(OC)cc1
CAS: 321856-71-7
Name: ethyl 2,2-difluoro-3-(4-methoxyphenyl)propanoate
SMILES: CCOC(=O)C(F)(F)Cc1ccc(OC)cc1

Molecular Processing

Molecular formula
C12H14F2O3
Molecular weight
244.24
Exact mass
244.0911
XLogP
2.44
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
58.28

Supplementary Information

InChIKey: KMONEYPZWPXIJO-UHFFFAOYSA-N
Synonyme
ethyl 2,2-difluoro-3-(4-methoxyphenyl)propanoate321856-71-7SCHEMBL3912206DB-230346G61963Ethyl 2,2-difluoro-3-(4-methoxyphenyl)-propionate
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