CID 159844009

H3BFO2 — CID 159844009

IUPAC—
SMILESF.O[B]O
InChIInChI=1S/BH2O2.FH/c2-1-3;/h2-3H;1H
InChIKeyYKZQQANBLRHBJJ-UHFFFAOYSA-N
MW64.83 g/mol
LogP-1.34
Rot. Bonds

About CID 159844009

CID 159844009 (PubChem CID 159844009) has the molecular formula H3BFO2 and a molecular weight of 64.83 g/mol.

Molecular Properties

Compound NameCID 159844009
PubChem CID159844009
Molecular FormulaH3BFO2
Molecular Weight64.83 g/mol
Exact Mass65.02
IUPAC Name—
SMILESF.O[B]O
InChIInChI=1S/BH2O2.FH/c2-1-3;/h2-3H;1H
InChIKeyYKZQQANBLRHBJJ-UHFFFAOYSA-N
XLogP-1.34
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50064.83
LogP ≤ 5-1.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 159844009?
The IUPAC name of CID 159844009 (CID 159844009) is not available.
What is the SMILES notation for CID 159844009?
The canonical SMILES for CID 159844009 is F.O[B]O.
What is the InChIKey of CID 159844009?
The InChIKey is YKZQQANBLRHBJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/BH2O2.FH/c2-1-3;/h2-3H;1H.
What are the key properties of CID 159844009?
CID 159844009 has a molecular weight of 64.83 g/mol, XLogP of -1.34, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159844009 is sourced from PubChem (CID 159844009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).