CCOC(=O)c1ccc(CP(=O)(OCC)OCC)cc1
名称: 4-(diethoxyphosphorylmethyl)-benzoic acid ethyl ester
SMILES: CCOC(=O)c1ccc(CP(=O)(OCC)OCC)cc1

Molecular Processing

Molecular formula
C14H21O5P
Molecular weight
300.29
Exact mass
300.1127
XLogP
3.63
TPSA
61.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
76.96

Supplementary Information

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