2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C11H19BO2 — CID 51341975

IUPAC2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SMILESCC1(C)OB(/C=C\C2CC2)OC1(C)C
InChIInChI=1S/C11H19BO2/c1-10(2)11(3,4)14-12(13-10)8-7-9-5-6-9/h7-9H,5-6H2,1-4H3/b8-7-
InChIKeyFCWYPDPDAZGFRJ-FPLPWBNLSA-N
MW194.08 g/mol
LogP2.58
Rot. Bonds2

About 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (PubChem CID 51341975) has the molecular formula C11H19BO2 and a molecular weight of 194.08 g/mol. Its IUPAC name is 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.

Molecular Properties

Compound Name2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
PubChem CID51341975
Molecular FormulaC11H19BO2
Molecular Weight194.08 g/mol
Exact Mass194.15
IUPAC Name2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SMILESCC1(C)OB(/C=C\C2CC2)OC1(C)C
InChIInChI=1S/C11H19BO2/c1-10(2)11(3,4)14-12(13-10)8-7-9-5-6-9/h7-9H,5-6H2,1-4H3/b8-7-
InChIKeyFCWYPDPDAZGFRJ-FPLPWBNLSA-N
XLogP2.58
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.08
LogP ≤ 52.58
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 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane?
The IUPAC name of 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CID 51341975) is 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.
What is the SMILES notation for 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane?
The canonical SMILES for 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is CC1(C)OB(/C=C\C2CC2)OC1(C)C.
What is the InChIKey of 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane?
The InChIKey is FCWYPDPDAZGFRJ-FPLPWBNLSA-N. The full InChI is InChI=1S/C11H19BO2/c1-10(2)11(3,4)14-12(13-10)8-7-9-5-6-9/h7-9H,5-6H2,1-4H3/b8-7-.
What are the key properties of 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane?
2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane has a molecular weight of 194.08 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2-cyclopropylethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is sourced from PubChem (CID 51341975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).