CID 10909489

B3Ti — CID 10909489

IUPAC—
SMILES[B-].[B-].[B-].[Ti+3]
InChIInChI=1S/3B.Ti/q3*-1;+3
InChIKeyZQDNYTNXEXEYPA-UHFFFAOYSA-N
MW80.30 g/mol
LogP-1.14
Rot. Bonds

About CID 10909489

CID 10909489 (PubChem CID 10909489) has the molecular formula B3Ti and a molecular weight of 80.30 g/mol.

Molecular Properties

Compound NameCID 10909489
PubChem CID10909489
Molecular FormulaB3Ti
Molecular Weight80.30 g/mol
Exact Mass80.98
IUPAC Name—
SMILES[B-].[B-].[B-].[Ti+3]
InChIInChI=1S/3B.Ti/q3*-1;+3
InChIKeyZQDNYTNXEXEYPA-UHFFFAOYSA-N
XLogP-1.14
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50080.30
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 CID 10909489?
The IUPAC name of CID 10909489 (CID 10909489) is not available.
What is the SMILES notation for CID 10909489?
The canonical SMILES for CID 10909489 is [B-].[B-].[B-].[Ti+3].
What is the InChIKey of CID 10909489?
The InChIKey is ZQDNYTNXEXEYPA-UHFFFAOYSA-N. The full InChI is InChI=1S/3B.Ti/q3*-1;+3.
What are the key properties of CID 10909489?
CID 10909489 has a molecular weight of 80.30 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 CID 10909489 is sourced from PubChem (CID 10909489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).