이름: iprobenfos
SMILES:
CC(C)OP(=O)(OC(C)C)SCc1ccccc1Molecular Processing
Molecular formula
C13H21O3PS
Molecular weight
288.35
Exact mass
288.0949
XLogP
4.88
TPSA
35.53
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
18
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
0.538
Molar refractivity
77.79
Supplementary Information
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