Name: tetraethyl 1-naphthylthiomethanediphosphonate
SMILES:
CCOP(=O)(OCC)C(c1cccc2ccccc12)P(=S)(OCC)OCCMolecular Processing
Molecular formula
C19H28O5P2S
Molecular weight
430.44
Exact mass
430.1133
XLogP
6.49
TPSA
53.99
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
27
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
115.08
Supplementary Information
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