methyl-diphenyl-(phenylsulfanylmethyl)silane

C20H20SSi — CID 15262880

IUPACmethyl-diphenyl-(phenylsulfanylmethyl)silane
SMILESC[Si](CSc1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20SSi/c1-22(19-13-7-3-8-14-19,20-15-9-4-10-16-20)17-21-18-11-5-2-6-12-18/h2-16H,17H2,1H3
InChIKeyVRHMWOHQNKEXMQ-UHFFFAOYSA-N
MW320.53 g/mol
LogP4.21
Rot. Bonds5

About methyl-diphenyl-(phenylsulfanylmethyl)silane

methyl-diphenyl-(phenylsulfanylmethyl)silane (PubChem CID 15262880) has the molecular formula C20H20SSi and a molecular weight of 320.53 g/mol. Its IUPAC name is methyl-diphenyl-(phenylsulfanylmethyl)silane.

Molecular Properties

Compound Namemethyl-diphenyl-(phenylsulfanylmethyl)silane
PubChem CID15262880
Molecular FormulaC20H20SSi
Molecular Weight320.53 g/mol
Exact Mass320.11
IUPAC Namemethyl-diphenyl-(phenylsulfanylmethyl)silane
SMILESC[Si](CSc1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H20SSi/c1-22(19-13-7-3-8-14-19,20-15-9-4-10-16-20)17-21-18-11-5-2-6-12-18/h2-16H,17H2,1H3
InChIKeyVRHMWOHQNKEXMQ-UHFFFAOYSA-N
XLogP4.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.53
LogP ≤ 54.21
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

Phosphine, tris(p-methylthiophenyl)-
CID 207408
Silane, trimethyl((phenylthio)methyl)-
CID 140295
Tris(phenylthio)methane
CID 615706
Triphenylsulfonium chloride
CID 61343
Phosphine, tris(2-(methylthio)phenyl)-
CID 398155
Triphenylsulfonium
CID 61344
10,10-Dimethylphenothiasilin
CID 143807
[2-(Methylsulfanyl)phenyl](diphenyl)phosphane
CID 329211
Silane, triphenyl(phenylthio)-
CID 11748971
Phosphine sulfide, tris(p-methylthiophenyl)-
CID 3057410
1,1,3-Tris(phenylthio)-1-propene
CID 4048974
Tetrakis(phenylthiomethyl)silane
CID 4525055

Frequently Asked Questions

What is the IUPAC name of methyl-diphenyl-(phenylsulfanylmethyl)silane?
The IUPAC name of methyl-diphenyl-(phenylsulfanylmethyl)silane (CID 15262880) is methyl-diphenyl-(phenylsulfanylmethyl)silane.
What is the SMILES notation for methyl-diphenyl-(phenylsulfanylmethyl)silane?
The canonical SMILES for methyl-diphenyl-(phenylsulfanylmethyl)silane is C[Si](CSc1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of methyl-diphenyl-(phenylsulfanylmethyl)silane?
The InChIKey is VRHMWOHQNKEXMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20SSi/c1-22(19-13-7-3-8-14-19,20-15-9-4-10-16-20)17-21-18-11-5-2-6-12-18/h2-16H,17H2,1H3.
What are the key properties of methyl-diphenyl-(phenylsulfanylmethyl)silane?
methyl-diphenyl-(phenylsulfanylmethyl)silane has a molecular weight of 320.53 g/mol, XLogP of 4.21, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-diphenyl-(phenylsulfanylmethyl)silane is sourced from PubChem (CID 15262880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).