名称: phenyl N-(3-chloropropyl)-N-(2,2,2-trifluoroethyl)carbamate
SMILES:
O=C(Oc1ccccc1)N(CCCCl)CC(F)(F)FMolecular Processing
Molecular formula
C12H13ClF3NO2
Molecular weight
295.69
Exact mass
295.0587
XLogP
3.68
TPSA
29.54
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
19
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
0.417
Molar refractivity
65.43
Supplementary Information
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