Name: 4-(2,2,2-Trifluoro-ethoxy)-1H-pyrazole-3,5-dicarboxylic acid diethyl ester
SMILES:
CCOC(=O)c1n[nH]c(C(=O)OCC)c1OCC(F)(F)FMolecular Processing
Molecular formula
C11H13F3N2O5
Molecular weight
310.23
Exact mass
310.0777
XLogP
1.7
TPSA
90.51
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
62.05
Supplementary Information
Details werden geladen…
An 6 Reaktionen beteiligt→