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disodium [1-phosphonato-3-(3-trimethylsilylphenyl)propyl]phosphonic acid

disodium [1-phosphonato-3-(3-trimethylsilylphenyl)propyl]phosphonic acid

Systemtic Name:disodium [1-phosphonato-3-(3-trimethylsilylphenyl)propyl]phosphonic acid
Openeye Name:disodium [1-phosphonato-3-(3-trimethylsilylphenyl)propyl]phosphonic acid
CAS Name:disodium [1-phosphonato-3-(3-trimethylsilylphenyl)propyl]phosphonic acid
IUPAC Name:disodium [1-phosphonato-3-(3-trimethylsilylphenyl)propyl]phosphonic acid
Traditional Name:disodium [1-phosphonato-3-(3-trimethylsilylphenyl)propyl]phosphonic acid
Formula: C12H20Na2O6P2Si
MolecularWeight: 396.296162
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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C)C1=CC=CC(=C1)CCC(P(=O)(O)O)P(=O)([O-])[O-].[Na+].[Na+]


Isomeric SMILES

C[Si](C)(C)C1=CC=CC(=C1)CCC(P(=O)(O)O)P(=O)([O-])[O-].[Na+].[Na+]


InChI

InChI=1S/C12H22O6P2Si.2Na/c1-21(2,3)11-6-4-5-10(9-11)7-8-12(19(13,14)15)20(16,17)18;;/h4-6,9,12H,7-8H2,1-3H3,(H2,13,14,15)(H2,16,17,18);;/q;2*+1/p-2


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