이름: 2,2-dimethyl-3-(3,3,3-trifluoro-2-methoxy-prop-1-enyl)-cyclopropanecarboxylic acid
SMILES:
COC(=CC1C(C(=O)O)C1(C)C)C(F)(F)FMolecular Processing
Molecular formula
C10H13F3O3
Molecular weight
238.2
Exact mass
238.0817
XLogP
2.44
TPSA
46.53
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
49.54
Supplementary Information
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