prop-1-en-1-ol;trimethoxy(propyl)silane

C9H22O4Si — CID 174645854

IUPACprop-1-en-1-ol;trimethoxy(propyl)silane
SMILESCC=CO.CCC[Si](OC)(OC)OC
InChIInChI=1S/C6H16O3Si.C3H6O/c1-5-6-10(7-2,8-3)9-4;1-2-3-4/h5-6H2,1-4H3;2-4H,1H3
InChIKeySHENCAIPMPPRHG-UHFFFAOYSA-N
MW222.36 g/mol
LogP2.35
Rot. Bonds5

About prop-1-en-1-ol;trimethoxy(propyl)silane

prop-1-en-1-ol;trimethoxy(propyl)silane (PubChem CID 174645854) has the molecular formula C9H22O4Si and a molecular weight of 222.36 g/mol. Its IUPAC name is prop-1-en-1-ol;trimethoxy(propyl)silane.

Molecular Properties

Compound Nameprop-1-en-1-ol;trimethoxy(propyl)silane
PubChem CID174645854
Molecular FormulaC9H22O4Si
Molecular Weight222.36 g/mol
Exact Mass222.13
IUPAC Nameprop-1-en-1-ol;trimethoxy(propyl)silane
SMILESCC=CO.CCC[Si](OC)(OC)OC
InChIInChI=1S/C6H16O3Si.C3H6O/c1-5-6-10(7-2,8-3)9-4;1-2-3-4/h5-6H2,1-4H3;2-4H,1H3
InChIKeySHENCAIPMPPRHG-UHFFFAOYSA-N
XLogP2.35
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of prop-1-en-1-ol;trimethoxy(propyl)silane?
The IUPAC name of prop-1-en-1-ol;trimethoxy(propyl)silane (CID 174645854) is prop-1-en-1-ol;trimethoxy(propyl)silane.
What is the SMILES notation for prop-1-en-1-ol;trimethoxy(propyl)silane?
The canonical SMILES for prop-1-en-1-ol;trimethoxy(propyl)silane is CC=CO.CCC[Si](OC)(OC)OC.
What is the InChIKey of prop-1-en-1-ol;trimethoxy(propyl)silane?
The InChIKey is SHENCAIPMPPRHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16O3Si.C3H6O/c1-5-6-10(7-2,8-3)9-4;1-2-3-4/h5-6H2,1-4H3;2-4H,1H3.
What are the key properties of prop-1-en-1-ol;trimethoxy(propyl)silane?
prop-1-en-1-ol;trimethoxy(propyl)silane has a molecular weight of 222.36 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for prop-1-en-1-ol;trimethoxy(propyl)silane is sourced from PubChem (CID 174645854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).