Triborane(5)

B3 — CID 6398624

IUPAC—
SMILES[B]B=[B]
InChIInChI=1S/B3/c1-3-2
InChIKeyDYUYJCUCDYWFLO-UHFFFAOYSA-N
MW32.44 g/mol
LogP-1.14
Rot. Bonds

About Triborane(5)

Triborane(5) (PubChem CID 6398624) has the molecular formula B3 and a molecular weight of 32.44 g/mol.

Molecular Properties

Compound NameTriborane(5)
PubChem CID6398624
Molecular FormulaB3
Molecular Weight32.44 g/mol
Exact Mass33.03
IUPAC Name—
SMILES[B]B=[B]
InChIInChI=1S/B3/c1-3-2
InChIKeyDYUYJCUCDYWFLO-UHFFFAOYSA-N
XLogP-1.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50032.44
LogP ≤ 5-1.14
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 Triborane(5)?
The IUPAC name of Triborane(5) (CID 6398624) is not available.
What is the SMILES notation for Triborane(5)?
The canonical SMILES for Triborane(5) is [B]B=[B].
What is the InChIKey of Triborane(5)?
The InChIKey is DYUYJCUCDYWFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/B3/c1-3-2.
What are the key properties of Triborane(5)?
Triborane(5) has a molecular weight of 32.44 g/mol, XLogP of -1.14, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Triborane(5) is sourced from PubChem (CID 6398624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).