dimethyltin;3H-dithiole

C5H10S2Sn — CID 175019333

IUPACdimethyltin;3H-dithiole
SMILESC1=CSSC1.C[Sn]C
InChIInChI=1S/C3H4S2.2CH3.Sn/c1-2-4-5-3-1;;;/h1-2H,3H2;2*1H3;
InChIKeySJMSIDDWUUVFMQ-UHFFFAOYSA-N
MW252.98 g/mol
LogP2.68
Rot. Bonds

About dimethyltin;3H-dithiole

dimethyltin;3H-dithiole (PubChem CID 175019333) has the molecular formula C5H10S2Sn and a molecular weight of 252.98 g/mol. Its IUPAC name is dimethyltin;3H-dithiole.

Molecular Properties

Compound Namedimethyltin;3H-dithiole
PubChem CID175019333
Molecular FormulaC5H10S2Sn
Molecular Weight252.98 g/mol
Exact Mass253.92
IUPAC Namedimethyltin;3H-dithiole
SMILESC1=CSSC1.C[Sn]C
InChIInChI=1S/C3H4S2.2CH3.Sn/c1-2-4-5-3-1;;;/h1-2H,3H2;2*1H3;
InChIKeySJMSIDDWUUVFMQ-UHFFFAOYSA-N
XLogP2.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.98
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyltin;3H-dithiole?
The IUPAC name of dimethyltin;3H-dithiole (CID 175019333) is dimethyltin;3H-dithiole.
What is the SMILES notation for dimethyltin;3H-dithiole?
The canonical SMILES for dimethyltin;3H-dithiole is C1=CSSC1.C[Sn]C.
What is the InChIKey of dimethyltin;3H-dithiole?
The InChIKey is SJMSIDDWUUVFMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4S2.2CH3.Sn/c1-2-4-5-3-1;;;/h1-2H,3H2;2*1H3;.
What are the key properties of dimethyltin;3H-dithiole?
dimethyltin;3H-dithiole has a molecular weight of 252.98 g/mol, XLogP of 2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyltin;3H-dithiole is sourced from PubChem (CID 175019333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).