CID 175098198

H5BClF4 — CID 175098198

IUPAC—
SMILESCl.F.F.F.F.[B]
InChIInChI=1S/B.ClH.4FH/h;5*1H
InChIKeyNPAZQZHJQHCXSO-UHFFFAOYSA-N
MW127.30 g/mol
LogP0.65
Rot. Bonds

About CID 175098198

CID 175098198 (PubChem CID 175098198) has the molecular formula H5BClF4 and a molecular weight of 127.30 g/mol.

Molecular Properties

Compound NameCID 175098198
PubChem CID175098198
Molecular FormulaH5BClF4
Molecular Weight127.30 g/mol
Exact Mass127.01
IUPAC Name—
SMILESCl.F.F.F.F.[B]
InChIInChI=1S/B.ClH.4FH/h;5*1H
InChIKeyNPAZQZHJQHCXSO-UHFFFAOYSA-N
XLogP0.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.30
LogP ≤ 50.65
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 175098198?
The IUPAC name of CID 175098198 (CID 175098198) is not available.
What is the SMILES notation for CID 175098198?
The canonical SMILES for CID 175098198 is Cl.F.F.F.F.[B].
What is the InChIKey of CID 175098198?
The InChIKey is NPAZQZHJQHCXSO-UHFFFAOYSA-N. The full InChI is InChI=1S/B.ClH.4FH/h;5*1H.
What are the key properties of CID 175098198?
CID 175098198 has a molecular weight of 127.30 g/mol, XLogP of 0.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175098198 is sourced from PubChem (CID 175098198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).