tetrakis(1-sulfinatoethane);tin(4+)

C8H20O8S4Sn — CID 175343513

IUPACtetrakis(1-sulfinatoethane);tin(4+)
SMILESCC[S-](=O)=O.CC[S-](=O)=O.CC[S-](=O)=O.CC[S-](=O)=O.[Sn+4]
InChIInChI=1S/4C2H5O2S.Sn/c4*1-2-5(3)4;/h4*2H2,1H3;/q4*-1;+4
InChIKeyZYROLHMTHBBFSX-UHFFFAOYSA-N
MW491.22 g/mol
LogP0.88
Rot. Bonds4

About tetrakis(1-sulfinatoethane);tin(4+)

tetrakis(1-sulfinatoethane);tin(4+) (PubChem CID 175343513) has the molecular formula C8H20O8S4Sn and a molecular weight of 491.22 g/mol. Its IUPAC name is tetrakis(1-sulfinatoethane);tin(4+).

Molecular Properties

Compound Nametetrakis(1-sulfinatoethane);tin(4+)
PubChem CID175343513
Molecular FormulaC8H20O8S4Sn
Molecular Weight491.22 g/mol
Exact Mass491.91
IUPAC Nametetrakis(1-sulfinatoethane);tin(4+)
SMILESCC[S-](=O)=O.CC[S-](=O)=O.CC[S-](=O)=O.CC[S-](=O)=O.[Sn+4]
InChIInChI=1S/4C2H5O2S.Sn/c4*1-2-5(3)4;/h4*2H2,1H3;/q4*-1;+4
InChIKeyZYROLHMTHBBFSX-UHFFFAOYSA-N
XLogP0.88
TPSA136.56 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500491.22
LogP ≤ 50.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Related Compounds

methane;1-sulfinatopentane;yttrium
CID 159303651
[bis(trifluoromethyl)amino]-oxosulfanium;butane
CID 172680213
Ethyl stibamine
CID 14195642
propanal;trihydrochloride
CID 140558923
propanal;propane
CID 91031727
methane;propanal
CID 159115270
butyl(oxo)stannane;λ2-stannane
CID 174903181
propanoate;tin(4+)
CID 167712674
ethanol;oxalic acid
CID 172820699
magnesium;hydride;propanal
CID 173025513
propanal;propane;yttrium
CID 161083042
butoxy(oxo)stannane
CID 173024009

Frequently Asked Questions

What is the IUPAC name of tetrakis(1-sulfinatoethane);tin(4+)?
The IUPAC name of tetrakis(1-sulfinatoethane);tin(4+) (CID 175343513) is tetrakis(1-sulfinatoethane);tin(4+).
What is the SMILES notation for tetrakis(1-sulfinatoethane);tin(4+)?
The canonical SMILES for tetrakis(1-sulfinatoethane);tin(4+) is CC[S-](=O)=O.CC[S-](=O)=O.CC[S-](=O)=O.CC[S-](=O)=O.[Sn+4].
What is the InChIKey of tetrakis(1-sulfinatoethane);tin(4+)?
The InChIKey is ZYROLHMTHBBFSX-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H5O2S.Sn/c4*1-2-5(3)4;/h4*2H2,1H3;/q4*-1;+4.
What are the key properties of tetrakis(1-sulfinatoethane);tin(4+)?
tetrakis(1-sulfinatoethane);tin(4+) has a molecular weight of 491.22 g/mol, XLogP of 0.88, 4 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(1-sulfinatoethane);tin(4+) is sourced from PubChem (CID 175343513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).