O=P(O)(O)C(c1cccc2ccccc12)P(O)(O)=S
SMILES: O=P(O)(O)C(c1cccc2ccccc12)P(O)(O)=S

Molecular Processing

Molecular formula
C11H12O5P2S
Molecular weight
318.23
Exact mass
317.9881
XLogP
2.31
TPSA
97.99
H-bond donors
4
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
19
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
0.091
Molar refractivity
77.46

Supplementary Information

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