TRIBUTYLTIN HYDROXIDE

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Keyword(s): Human Metabolites
Molecule Category Free-form
UNII V3I605YM3E

Structure

InChI Key GMVHICBNQJYKSP-UHFFFAOYSA-M
Smiles [OH-].CCCC[Sn+](CCCC)CCCC
InChI
InChI=1/3C4H9.H2O.Sn/c3*1-3-4-2;;/h3*1,3-4H2,2H3;1H2;/q;;;;+1/p-1/rC12H27Sn.H2O/c1-4-7-10-13(11-8-5-2)12-9-6-3;/h4-12H2,1-3H3;1H2/q+1;/p-1

Physicochemical Descriptors

Property Name Value
Molecular Formula C12H28OSn
Molecular Weight 308.12
AlogP 4.7
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 9.0
Polar Surface Area 30.0
Heavy Atoms 14.0

Cross References

Resources Reference
CAS NUMBER 1067-97-6
NORMAN SUSDAT
FDA SRS V3I605YM3E
CONTENTS