dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane

C20H20O2SSi — CID 174820456

IUPACdimethoxy-phenyl-(2-phenylsulfanylphenyl)silane
SMILESCO[Si](OC)(c1ccccc1)c1ccccc1Sc1ccccc1
InChIInChI=1S/C20H20O2SSi/c1-21-24(22-2,18-13-7-4-8-14-18)20-16-10-9-15-19(20)23-17-11-5-3-6-12-17/h3-16H,1-2H3
InChIKeyRSASZVUYAVLOSR-UHFFFAOYSA-N
MW352.53 g/mol
LogP3.69
Rot. Bonds6

About dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane

dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane (PubChem CID 174820456) has the molecular formula C20H20O2SSi and a molecular weight of 352.53 g/mol. Its IUPAC name is dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane.

Molecular Properties

Compound Namedimethoxy-phenyl-(2-phenylsulfanylphenyl)silane
PubChem CID174820456
Molecular FormulaC20H20O2SSi
Molecular Weight352.53 g/mol
Exact Mass352.10
IUPAC Namedimethoxy-phenyl-(2-phenylsulfanylphenyl)silane
SMILESCO[Si](OC)(c1ccccc1)c1ccccc1Sc1ccccc1
InChIInChI=1S/C20H20O2SSi/c1-21-24(22-2,18-13-7-4-8-14-18)20-16-10-9-15-19(20)23-17-11-5-3-6-12-17/h3-16H,1-2H3
InChIKeyRSASZVUYAVLOSR-UHFFFAOYSA-N
XLogP3.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.53
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane?
The IUPAC name of dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane (CID 174820456) is dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane.
What is the SMILES notation for dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane?
The canonical SMILES for dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane is CO[Si](OC)(c1ccccc1)c1ccccc1Sc1ccccc1.
What is the InChIKey of dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane?
The InChIKey is RSASZVUYAVLOSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20O2SSi/c1-21-24(22-2,18-13-7-4-8-14-18)20-16-10-9-15-19(20)23-17-11-5-3-6-12-17/h3-16H,1-2H3.
What are the key properties of dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane?
dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane has a molecular weight of 352.53 g/mol, XLogP of 3.69, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-phenyl-(2-phenylsulfanylphenyl)silane is sourced from PubChem (CID 174820456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).