1-ethenylsulfanylpropyl(trimethoxy)silane

C8H18O3SSi — CID 21425881

IUPAC1-ethenylsulfanylpropyl(trimethoxy)silane
SMILESC=CSC(CC)[Si](OC)(OC)OC
InChIInChI=1S/C8H18O3SSi/c1-6-8(12-7-2)13(9-3,10-4)11-5/h7-8H,2,6H2,1,3-5H3
InChIKeyNLMDIRILJWDJIQ-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.06
Rot. Bonds7

About 1-ethenylsulfanylpropyl(trimethoxy)silane

1-ethenylsulfanylpropyl(trimethoxy)silane (PubChem CID 21425881) has the molecular formula C8H18O3SSi and a molecular weight of 222.38 g/mol. Its IUPAC name is 1-ethenylsulfanylpropyl(trimethoxy)silane.

Molecular Properties

Compound Name1-ethenylsulfanylpropyl(trimethoxy)silane
PubChem CID21425881
Molecular FormulaC8H18O3SSi
Molecular Weight222.38 g/mol
Exact Mass222.07
IUPAC Name1-ethenylsulfanylpropyl(trimethoxy)silane
SMILESC=CSC(CC)[Si](OC)(OC)OC
InChIInChI=1S/C8H18O3SSi/c1-6-8(12-7-2)13(9-3,10-4)11-5/h7-8H,2,6H2,1,3-5H3
InChIKeyNLMDIRILJWDJIQ-UHFFFAOYSA-N
XLogP2.06
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[3-(Ethylsulfanyl)propyl](trimethoxy)silane
CID 12484752
[(Butylthio)methyl]trimethoxysilane
CID 12484755
Trimethoxy[3-(methylsulfanyl)propyl]silane
CID 13307608
3,3-Dimethoxy-2-oxa-6,9-dithia-3-silaundec-10-ene
CID 57242898
Trimethoxy(4-methylsulfanylbutyl)silane
CID 141035778
3-(Vinylthio)propyltrimethoxysilane
CID 144019
3,3-Dimethoxy-2-oxa-7,10-dithia-3-siladodec-11-ene
CID 71381592
3,3-Dimethoxy-2-oxa-5,8-dithia-3-siladec-9-ene
CID 71382528
Trimethoxy(2-propylsulfanylethyl)silane
CID 12484754
3-Butylsulfanylpropyl(trimethoxy)silane
CID 12484758
Trimethoxy(1-prop-2-enylsulfanylpropyl)silane
CID 20497339
Trimethoxy(2-methylsulfanylpentyl)silane
CID 20675042

Frequently Asked Questions

What is the IUPAC name of 1-ethenylsulfanylpropyl(trimethoxy)silane?
The IUPAC name of 1-ethenylsulfanylpropyl(trimethoxy)silane (CID 21425881) is 1-ethenylsulfanylpropyl(trimethoxy)silane.
What is the SMILES notation for 1-ethenylsulfanylpropyl(trimethoxy)silane?
The canonical SMILES for 1-ethenylsulfanylpropyl(trimethoxy)silane is C=CSC(CC)[Si](OC)(OC)OC.
What is the InChIKey of 1-ethenylsulfanylpropyl(trimethoxy)silane?
The InChIKey is NLMDIRILJWDJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O3SSi/c1-6-8(12-7-2)13(9-3,10-4)11-5/h7-8H,2,6H2,1,3-5H3.
What are the key properties of 1-ethenylsulfanylpropyl(trimethoxy)silane?
1-ethenylsulfanylpropyl(trimethoxy)silane has a molecular weight of 222.38 g/mol, XLogP of 2.06, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenylsulfanylpropyl(trimethoxy)silane is sourced from PubChem (CID 21425881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).