(Isopropylprenyl)borane

C8H15B — CID 132990933

IUPAC—
SMILES[B]C(C=C(C)C)C(C)C
InChIInChI=1S/C8H15B/c1-6(2)5-8(9)7(3)4/h5,7-8H,1-4H3
InChIKeyCJVDBEDQIUFVLE-UHFFFAOYSA-N
MW122.02 g/mol
LogP2.57
Rot. Bonds2

About (Isopropylprenyl)borane

(Isopropylprenyl)borane (PubChem CID 132990933) has the molecular formula C8H15B and a molecular weight of 122.02 g/mol.

Molecular Properties

Compound Name(Isopropylprenyl)borane
PubChem CID132990933
Molecular FormulaC8H15B
Molecular Weight122.02 g/mol
Exact Mass122.13
IUPAC Name—
SMILES[B]C(C=C(C)C)C(C)C
InChIInChI=1S/C8H15B/c1-6(2)5-8(9)7(3)4/h5,7-8H,1-4H3
InChIKeyCJVDBEDQIUFVLE-UHFFFAOYSA-N
XLogP2.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.02
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 (Isopropylprenyl)borane?
The IUPAC name of (Isopropylprenyl)borane (CID 132990933) is not available.
What is the SMILES notation for (Isopropylprenyl)borane?
The canonical SMILES for (Isopropylprenyl)borane is [B]C(C=C(C)C)C(C)C.
What is the InChIKey of (Isopropylprenyl)borane?
The InChIKey is CJVDBEDQIUFVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15B/c1-6(2)5-8(9)7(3)4/h5,7-8H,1-4H3.
What are the key properties of (Isopropylprenyl)borane?
(Isopropylprenyl)borane has a molecular weight of 122.02 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Isopropylprenyl)borane is sourced from PubChem (CID 132990933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).