3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane

C8H17BO2Si — CID 71337958

IUPAC3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane
SMILESC[Si](C)(C)C=CCB1OCCO1
InChIInChI=1S/C8H17BO2Si/c1-12(2,3)8-4-5-9-10-6-7-11-9/h4,8H,5-7H2,1-3H3
InChIKeyGYGVFCLOAGUWRB-UHFFFAOYSA-N
MW184.12 g/mol
LogP1.96
Rot. Bonds3

About 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane

3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane (PubChem CID 71337958) has the molecular formula C8H17BO2Si and a molecular weight of 184.12 g/mol. Its IUPAC name is 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane.

Molecular Properties

Compound Name3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane
PubChem CID71337958
Molecular FormulaC8H17BO2Si
Molecular Weight184.12 g/mol
Exact Mass184.11
IUPAC Name3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane
SMILESC[Si](C)(C)C=CCB1OCCO1
InChIInChI=1S/C8H17BO2Si/c1-12(2,3)8-4-5-9-10-6-7-11-9/h4,8H,5-7H2,1-3H3
InChIKeyGYGVFCLOAGUWRB-UHFFFAOYSA-N
XLogP1.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.12
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane?
The IUPAC name of 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane (CID 71337958) is 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane.
What is the SMILES notation for 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane?
The canonical SMILES for 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane is C[Si](C)(C)C=CCB1OCCO1.
What is the InChIKey of 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane?
The InChIKey is GYGVFCLOAGUWRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17BO2Si/c1-12(2,3)8-4-5-9-10-6-7-11-9/h4,8H,5-7H2,1-3H3.
What are the key properties of 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane?
3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane has a molecular weight of 184.12 g/mol, XLogP of 1.96, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3,2-dioxaborolan-2-yl)prop-1-enyl-trimethylsilane is sourced from PubChem (CID 71337958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).