2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C11H21BO3 — CID 134970024

IUPAC2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SMILESCC1(C)OB(OC2CCCC2)OC1(C)C
InChIInChI=1S/C11H21BO3/c1-10(2)11(3,4)15-12(14-10)13-9-7-5-6-8-9/h9H,5-8H2,1-4H3
InChIKeyRUIYFIMUTATAJO-UHFFFAOYSA-N
MW212.10 g/mol
LogP2.53
Rot. Bonds2

About 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (PubChem CID 134970024) has the molecular formula C11H21BO3 and a molecular weight of 212.10 g/mol. Its IUPAC name is 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.

Molecular Properties

Compound Name2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
PubChem CID134970024
Molecular FormulaC11H21BO3
Molecular Weight212.10 g/mol
Exact Mass212.16
IUPAC Name2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SMILESCC1(C)OB(OC2CCCC2)OC1(C)C
InChIInChI=1S/C11H21BO3/c1-10(2)11(3,4)15-12(14-10)13-9-7-5-6-8-9/h9H,5-8H2,1-4H3
InChIKeyRUIYFIMUTATAJO-UHFFFAOYSA-N
XLogP2.53
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.10
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(Cyclopentyloxymethyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 162415414
2-(5-Methoxypentan-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 58940077
2-(5-Methoxypentan-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 58940078
4,4,5,5-Tetramethyl-2-(4-methylpentan-2-yloxy)-1,3,2-dioxaborolane
CID 90703740
2-Hexan-3-yloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 140147804
4,4,5,5-Tetramethyl-2-pentoxy-1,3,2-dioxaborolane
CID 147911213
Cyclopentane;2-(3-methoxypropyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 159879745
4-Ethyl-4,5,5-trimethyl-2-propan-2-yloxy-1,3,2-dioxaborolane
CID 173828823
2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)cyclopentan-1-ol
CID 115027716
3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-YL)cyclopentanol
CID 115027717
(5-Methyl)tetrahydrofuran-3-boronic acid pinacol ester
CID 133662318
2-(3-Methoxycyclopentyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 138109249

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane?
The IUPAC name of 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane (CID 134970024) is 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane.
What is the SMILES notation for 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane?
The canonical SMILES for 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is CC1(C)OB(OC2CCCC2)OC1(C)C.
What is the InChIKey of 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane?
The InChIKey is RUIYFIMUTATAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21BO3/c1-10(2)11(3,4)15-12(14-10)13-9-7-5-6-8-9/h9H,5-8H2,1-4H3.
What are the key properties of 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane?
2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane has a molecular weight of 212.10 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane is sourced from PubChem (CID 134970024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).