bis(methoxysulfanyl)-prop-2-enyl-propylsilane

C8H18O2S2Si — CID 88627456

IUPACbis(methoxysulfanyl)-prop-2-enyl-propylsilane
SMILESC=CC[Si](CCC)(SOC)SOC
InChIInChI=1S/C8H18O2S2Si/c1-5-7-13(8-6-2,11-9-3)12-10-4/h5H,1,6-8H2,2-4H3
InChIKeyXDSUMNCDCFTWDN-UHFFFAOYSA-N
MW238.45 g/mol
LogP3.61
Rot. Bonds8

About bis(methoxysulfanyl)-prop-2-enyl-propylsilane

bis(methoxysulfanyl)-prop-2-enyl-propylsilane (PubChem CID 88627456) has the molecular formula C8H18O2S2Si and a molecular weight of 238.45 g/mol. Its IUPAC name is bis(methoxysulfanyl)-prop-2-enyl-propylsilane.

Molecular Properties

Compound Namebis(methoxysulfanyl)-prop-2-enyl-propylsilane
PubChem CID88627456
Molecular FormulaC8H18O2S2Si
Molecular Weight238.45 g/mol
Exact Mass238.05
IUPAC Namebis(methoxysulfanyl)-prop-2-enyl-propylsilane
SMILESC=CC[Si](CCC)(SOC)SOC
InChIInChI=1S/C8H18O2S2Si/c1-5-7-13(8-6-2,11-9-3)12-10-4/h5H,1,6-8H2,2-4H3
InChIKeyXDSUMNCDCFTWDN-UHFFFAOYSA-N
XLogP3.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[dimethyl(prop-2-enyl)silyl]oxy-dimethyl-propylsilane
CID 14223255
prop-2-enyl-dipropoxy-propylsilane
CID 87857380
methoxy-tris(prop-2-enyl)silane
CID 22222919
dimethoxy-bis[3-tris(prop-2-enyl)silylpropyl]silane
CID 86726596
ethanol;trimethoxy(prop-2-enyl)silane
CID 87390018
1-(ethyl-prop-2-enyl-propylsilyl)-N,N-dimethylmethanamine
CID 87398259
hydroxy-pentyl-prop-2-enyl-silyloxysilane
CID 173210547
hydroxy-dimethoxy-prop-2-enylsilane
CID 90254495
1-[dimethoxy(prop-2-enyl)silyl]propane-1-thiol
CID 88627461
ethyl-(ethyl-methyl-prop-2-enylsilyl)oxy-methyl-prop-2-enylsilane
CID 139725530
trimethoxy-tris(prop-2-enyl)silylazanium bromide
CID 175251728
ethoxy-dimethyl-prop-2-enylsilane
CID 568563

Frequently Asked Questions

What is the IUPAC name of bis(methoxysulfanyl)-prop-2-enyl-propylsilane?
The IUPAC name of bis(methoxysulfanyl)-prop-2-enyl-propylsilane (CID 88627456) is bis(methoxysulfanyl)-prop-2-enyl-propylsilane.
What is the SMILES notation for bis(methoxysulfanyl)-prop-2-enyl-propylsilane?
The canonical SMILES for bis(methoxysulfanyl)-prop-2-enyl-propylsilane is C=CC[Si](CCC)(SOC)SOC.
What is the InChIKey of bis(methoxysulfanyl)-prop-2-enyl-propylsilane?
The InChIKey is XDSUMNCDCFTWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2S2Si/c1-5-7-13(8-6-2,11-9-3)12-10-4/h5H,1,6-8H2,2-4H3.
What are the key properties of bis(methoxysulfanyl)-prop-2-enyl-propylsilane?
bis(methoxysulfanyl)-prop-2-enyl-propylsilane has a molecular weight of 238.45 g/mol, XLogP of 3.61, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(methoxysulfanyl)-prop-2-enyl-propylsilane is sourced from PubChem (CID 88627456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).