Potassium hydridotris(3-methylbutan-2-yl)borate(1-)

C15H33BK — CID 23676661

IUPAC—
SMILESCC(C)C(C)[B-](C(C)C(C)C)C(C)C(C)C.[K+]
InChIInChI=1S/C15H33B.K/c1-10(2)13(7)16(14(8)11(3)4)15(9)12(5)6;/h10-15H,1-9H3;/q-1;+1
InChIKeyDMAHEVBTBUVEMP-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.62
Rot. Bonds6

About Potassium hydridotris(3-methylbutan-2-yl)borate(1-)

Potassium hydridotris(3-methylbutan-2-yl)borate(1-) (PubChem CID 23676661) has the molecular formula C15H33BK and a molecular weight of 263.34 g/mol.

Molecular Properties

Compound NamePotassium hydridotris(3-methylbutan-2-yl)borate(1-)
PubChem CID23676661
Molecular FormulaC15H33BK
Molecular Weight263.34 g/mol
Exact Mass263.23
IUPAC Name—
SMILESCC(C)C(C)[B-](C(C)C(C)C)C(C)C(C)C.[K+]
InChIInChI=1S/C15H33B.K/c1-10(2)13(7)16(14(8)11(3)4)15(9)12(5)6;/h10-15H,1-9H3;/q-1;+1
InChIKeyDMAHEVBTBUVEMP-UHFFFAOYSA-N
XLogP2.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 Potassium hydridotris(3-methylbutan-2-yl)borate(1-)?
The IUPAC name of Potassium hydridotris(3-methylbutan-2-yl)borate(1-) (CID 23676661) is not available.
What is the SMILES notation for Potassium hydridotris(3-methylbutan-2-yl)borate(1-)?
The canonical SMILES for Potassium hydridotris(3-methylbutan-2-yl)borate(1-) is CC(C)C(C)[B-](C(C)C(C)C)C(C)C(C)C.[K+].
What is the InChIKey of Potassium hydridotris(3-methylbutan-2-yl)borate(1-)?
The InChIKey is DMAHEVBTBUVEMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33B.K/c1-10(2)13(7)16(14(8)11(3)4)15(9)12(5)6;/h10-15H,1-9H3;/q-1;+1.
What are the key properties of Potassium hydridotris(3-methylbutan-2-yl)borate(1-)?
Potassium hydridotris(3-methylbutan-2-yl)borate(1-) has a molecular weight of 263.34 g/mol, XLogP of 2.62, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Potassium hydridotris(3-methylbutan-2-yl)borate(1-) is sourced from PubChem (CID 23676661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).