名称: 3-methyl-2-oxooct-5-inylphosphonic acid dimethyl ester
SMILES:
CCC#CCC(C)C(=O)CP(=O)(OC)OCMolecular Processing
Molecular formula
C11H19O4P
Molecular weight
246.24
Exact mass
246.1021
XLogP
2.48
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
16
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.727
Molar refractivity
63.35
Supplementary Information
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