1-methyl-1-prop-2-enoxysilinane

C9H18OSi — CID 593203

IUPAC1-methyl-1-prop-2-enoxysilinane
SMILESC=CCO[Si]1(C)CCCCC1
InChIInChI=1S/C9H18OSi/c1-3-7-10-11(2)8-5-4-6-9-11/h3H,1,4-9H2,2H3
InChIKeyKPOOINPLBDPPBY-UHFFFAOYSA-N
MW170.33 g/mol
LogP2.95
Rot. Bonds3

About 1-methyl-1-prop-2-enoxysilinane

1-methyl-1-prop-2-enoxysilinane (PubChem CID 593203) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is 1-methyl-1-prop-2-enoxysilinane.

Molecular Properties

Compound Name1-methyl-1-prop-2-enoxysilinane
PubChem CID593203
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Name1-methyl-1-prop-2-enoxysilinane
SMILESC=CCO[Si]1(C)CCCCC1
InChIInChI=1S/C9H18OSi/c1-3-7-10-11(2)8-5-4-6-9-11/h3H,1,4-9H2,2H3
InChIKeyKPOOINPLBDPPBY-UHFFFAOYSA-N
XLogP2.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-prop-2-enoxysilinane?
The IUPAC name of 1-methyl-1-prop-2-enoxysilinane (CID 593203) is 1-methyl-1-prop-2-enoxysilinane.
What is the SMILES notation for 1-methyl-1-prop-2-enoxysilinane?
The canonical SMILES for 1-methyl-1-prop-2-enoxysilinane is C=CCO[Si]1(C)CCCCC1.
What is the InChIKey of 1-methyl-1-prop-2-enoxysilinane?
The InChIKey is KPOOINPLBDPPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18OSi/c1-3-7-10-11(2)8-5-4-6-9-11/h3H,1,4-9H2,2H3.
What are the key properties of 1-methyl-1-prop-2-enoxysilinane?
1-methyl-1-prop-2-enoxysilinane has a molecular weight of 170.33 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-prop-2-enoxysilinane is sourced from PubChem (CID 593203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).