[(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane

C10H21BO2Si — CID 168948884

IUPAC[(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane
SMILESCC1OB(C/C=C/[Si](C)(C)C)OC1C
InChIInChI=1S/C10H21BO2Si/c1-9-10(2)13-11(12-9)7-6-8-14(3,4)5/h6,8-10H,7H2,1-5H3/b8-6+
InChIKeyZXBLDGMGJZSOQC-SOFGYWHQSA-N
MW212.17 g/mol
LogP2.73
Rot. Bonds3

About [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane

[(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane (PubChem CID 168948884) has the molecular formula C10H21BO2Si and a molecular weight of 212.17 g/mol. Its IUPAC name is [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane
PubChem CID168948884
Molecular FormulaC10H21BO2Si
Molecular Weight212.17 g/mol
Exact Mass212.14
IUPAC Name[(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane
SMILESCC1OB(C/C=C/[Si](C)(C)C)OC1C
InChIInChI=1S/C10H21BO2Si/c1-9-10(2)13-11(12-9)7-6-8-14(3,4)5/h6,8-10H,7H2,1-5H3/b8-6+
InChIKeyZXBLDGMGJZSOQC-SOFGYWHQSA-N
XLogP2.73
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.17
LogP ≤ 52.73
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 [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane?
The IUPAC name of [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane (CID 168948884) is [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane.
What is the SMILES notation for [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane?
The canonical SMILES for [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane is CC1OB(C/C=C/[Si](C)(C)C)OC1C.
What is the InChIKey of [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane?
The InChIKey is ZXBLDGMGJZSOQC-SOFGYWHQSA-N. The full InChI is InChI=1S/C10H21BO2Si/c1-9-10(2)13-11(12-9)7-6-8-14(3,4)5/h6,8-10H,7H2,1-5H3/b8-6+.
What are the key properties of [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane?
[(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane has a molecular weight of 212.17 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3-(4,5-dimethyl-1,3,2-dioxaborolan-2-yl)prop-1-enyl]-trimethylsilane is sourced from PubChem (CID 168948884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).