trimethyl-(3-methylphenyl)sulfanylsilane

C10H16SSi — CID 12755162

IUPACtrimethyl-(3-methylphenyl)sulfanylsilane
SMILESCc1cccc(S[Si](C)(C)C)c1
InChIInChI=1S/C10H16SSi/c1-9-6-5-7-10(8-9)11-12(2,3)4/h5-8H,1-4H3
InChIKeySKKVUXTWPVWKRE-UHFFFAOYSA-N
MW196.39 g/mol
LogP3.92
Rot. Bonds2

About trimethyl-(3-methylphenyl)sulfanylsilane

trimethyl-(3-methylphenyl)sulfanylsilane (PubChem CID 12755162) has the molecular formula C10H16SSi and a molecular weight of 196.39 g/mol. Its IUPAC name is trimethyl-(3-methylphenyl)sulfanylsilane.

Molecular Properties

Compound Nametrimethyl-(3-methylphenyl)sulfanylsilane
PubChem CID12755162
Molecular FormulaC10H16SSi
Molecular Weight196.39 g/mol
Exact Mass196.07
IUPAC Nametrimethyl-(3-methylphenyl)sulfanylsilane
SMILESCc1cccc(S[Si](C)(C)C)c1
InChIInChI=1S/C10H16SSi/c1-9-6-5-7-10(8-9)11-12(2,3)4/h5-8H,1-4H3
InChIKeySKKVUXTWPVWKRE-UHFFFAOYSA-N
XLogP3.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.39
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(3-trimethylsilylsulfanylphenyl)methanimine
CID 140768331
S-(3-methylphenyl)thiohydroxylamine;pentahydrofluoride
CID 173046661
azane;1,3-xylene;hydrochloride
CID 175000695
1-methyl-3-(4-methylphenyl)sulfanylbenzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene
CID 143856903
1,2-bis[(3-methylphenyl)sulfanyl]benzene
CID 58715664
(3-methylphenyl)sulfanylhydrazine
CID 117036019
ethane;1-methyl-3-propan-2-ylsulfanylbenzene
CID 172609121
2-(3-methylphenyl)sulfanylpropan-2-ol
CID 117034561
1-methyl-3-(2-phenylsulfanylethylsulfanyl)benzene
CID 79327094
1-(3-methylphenyl)sulfanylethanamine
CID 117032496
phosphane;tris(1,3-xylene)
CID 67351774
ethane;1,3-xylene
CID 54570178

Frequently Asked Questions

What is the IUPAC name of trimethyl-(3-methylphenyl)sulfanylsilane?
The IUPAC name of trimethyl-(3-methylphenyl)sulfanylsilane (CID 12755162) is trimethyl-(3-methylphenyl)sulfanylsilane.
What is the SMILES notation for trimethyl-(3-methylphenyl)sulfanylsilane?
The canonical SMILES for trimethyl-(3-methylphenyl)sulfanylsilane is Cc1cccc(S[Si](C)(C)C)c1.
What is the InChIKey of trimethyl-(3-methylphenyl)sulfanylsilane?
The InChIKey is SKKVUXTWPVWKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16SSi/c1-9-6-5-7-10(8-9)11-12(2,3)4/h5-8H,1-4H3.
What are the key properties of trimethyl-(3-methylphenyl)sulfanylsilane?
trimethyl-(3-methylphenyl)sulfanylsilane has a molecular weight of 196.39 g/mol, XLogP of 3.92, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3-methylphenyl)sulfanylsilane is sourced from PubChem (CID 12755162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).