2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane

C12H20S2Si2 — CID 71325110

IUPAC2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane
SMILESCC[Si]1(C)CCC[Si](S)(c2ccccc2)S1
InChIInChI=1S/C12H20S2Si2/c1-3-15(2)10-7-11-16(13,14-15)12-8-5-4-6-9-12/h4-6,8-9,13H,3,7,10-11H2,1-2H3
InChIKeyQSYYUOLILWHMLA-UHFFFAOYSA-N
MW284.60 g/mol
LogP4.00
Rot. Bonds2

About 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane

2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane (PubChem CID 71325110) has the molecular formula C12H20S2Si2 and a molecular weight of 284.60 g/mol. Its IUPAC name is 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane.

Molecular Properties

Compound Name2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane
PubChem CID71325110
Molecular FormulaC12H20S2Si2
Molecular Weight284.60 g/mol
Exact Mass284.05
IUPAC Name2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane
SMILESCC[Si]1(C)CCC[Si](S)(c2ccccc2)S1
InChIInChI=1S/C12H20S2Si2/c1-3-15(2)10-7-11-16(13,14-15)12-8-5-4-6-9-12/h4-6,8-9,13H,3,7,10-11H2,1-2H3
InChIKeyQSYYUOLILWHMLA-UHFFFAOYSA-N
XLogP4.00
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.60
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

2,4,6-trimethyl-2,4,6-triphenyl-1,3,5,2,4,6-trithiatrisilinane
CID 15717312
1,3-diethyl-1,3-diphenyl-1,3-disiletane
CID 139686277
1,1,2,6,6,7-hexamethyl-2,7-diphenyl-1,2,6,7-tetrasilecane
CID 11729896
6-ethyl-2-methyl-2-phenyloxasilinane
CID 175093318
2-methyl-2-phenyloxasilinane
CID 174568413
2,4,4,5,5-pentamethyl-2-phenyl-1,3,2,4,5-dithiatrisilolane
CID 101044204
1,1,2,2-tetraphenyldisilinane
CID 86071177
(1S,2Z,4R)-1,4-dimethyl-1,2,3,4-tetraphenyl-5,6,7,8-tetrahydro-1,4-disilocine
CID 15499078
1,1-diphenylsilocane
CID 69463623
1-(1-iodo-3-methylbutyl)-1-phenylsiletane
CID 15024819
4-methyl-4-phenyl-1,4-azasilinane
CID 66925910
1-(chloromethyl)-1-phenylsilolane
CID 71333765

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane?
The IUPAC name of 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane (CID 71325110) is 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane.
What is the SMILES notation for 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane?
The canonical SMILES for 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane is CC[Si]1(C)CCC[Si](S)(c2ccccc2)S1.
What is the InChIKey of 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane?
The InChIKey is QSYYUOLILWHMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20S2Si2/c1-3-15(2)10-7-11-16(13,14-15)12-8-5-4-6-9-12/h4-6,8-9,13H,3,7,10-11H2,1-2H3.
What are the key properties of 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane?
2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane has a molecular weight of 284.60 g/mol, XLogP of 4.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methyl-6-phenyl-6-sulfanyl-1,2,6-thiadisilinane is sourced from PubChem (CID 71325110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).