CID 174970477

BCoCrHfPtReTb — CID 174970477

IUPAC—
SMILES[B].[Co].[Cr].[Hf].[Pt].[Re].[Tb]
InChIInChI=1S/B.Co.Cr.Hf.Pt.Re.Tb
InChIKeyONSMAEYDSPCKRJ-UHFFFAOYSA-N
MW840.44 g/mol
LogP-0.39
Rot. Bonds

About CID 174970477

CID 174970477 (PubChem CID 174970477) has the molecular formula BCoCrHfPtReTb and a molecular weight of 840.44 g/mol.

Molecular Properties

Compound NameCID 174970477
PubChem CID174970477
Molecular FormulaBCoCrHfPtReTb
Molecular Weight840.44 g/mol
Exact Mass842.68
IUPAC Name—
SMILES[B].[Co].[Cr].[Hf].[Pt].[Re].[Tb]
InChIInChI=1S/B.Co.Cr.Hf.Pt.Re.Tb
InChIKeyONSMAEYDSPCKRJ-UHFFFAOYSA-N
XLogP-0.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500840.44
LogP ≤ 5-0.39
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 174970477?
The IUPAC name of CID 174970477 (CID 174970477) is not available.
What is the SMILES notation for CID 174970477?
The canonical SMILES for CID 174970477 is [B].[Co].[Cr].[Hf].[Pt].[Re].[Tb].
What is the InChIKey of CID 174970477?
The InChIKey is ONSMAEYDSPCKRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/B.Co.Cr.Hf.Pt.Re.Tb.
What are the key properties of CID 174970477?
CID 174970477 has a molecular weight of 840.44 g/mol, XLogP of -0.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174970477 is sourced from PubChem (CID 174970477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).