CID 173314961

H3BCl — CID 173314961

IUPAC—
SMILESCl.[B].[H][H]
InChIInChI=1S/B.ClH.H2/h;2*1H
InChIKeyGOGMIKIWFOYFOL-UHFFFAOYSA-N
MW49.29 g/mol
LogP0.29
Rot. Bonds

About CID 173314961

CID 173314961 (PubChem CID 173314961) has the molecular formula H3BCl and a molecular weight of 49.29 g/mol.

Molecular Properties

Compound NameCID 173314961
PubChem CID173314961
Molecular FormulaH3BCl
Molecular Weight49.29 g/mol
Exact Mass49.00
IUPAC Name—
SMILESCl.[B].[H][H]
InChIInChI=1S/B.ClH.H2/h;2*1H
InChIKeyGOGMIKIWFOYFOL-UHFFFAOYSA-N
XLogP0.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms2
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50049.29
LogP ≤ 50.29
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 173314961?
The IUPAC name of CID 173314961 (CID 173314961) is not available.
What is the SMILES notation for CID 173314961?
The canonical SMILES for CID 173314961 is Cl.[B].[H][H].
What is the InChIKey of CID 173314961?
The InChIKey is GOGMIKIWFOYFOL-UHFFFAOYSA-N. The full InChI is InChI=1S/B.ClH.H2/h;2*1H.
What are the key properties of CID 173314961?
CID 173314961 has a molecular weight of 49.29 g/mol, XLogP of 0.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173314961 is sourced from PubChem (CID 173314961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).