Phenol, barium salt (2:1)
TL;DR: Phenol, barium salt (2:1) (CAS 27696-24-8) is a chemical compound with molecular formula C12H10BaO2 and molecular weight 323.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
barium(2+) diphenoxide
Also Known As: Barium diphenolate, Phenol, barium salt, barium phenoxide, barium bisphenolate, Barium bisphenoxide
| Molecular Formula | C12H10BaO2 |
|---|---|
| Molecular Weight | 323.97 g/mol |
| LogP | 1.1396 |
| Topological Polar Surface Area | 46.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 323.97333 |
| Heavy Atoms | 15 |
| Complexity | 46.0 |
Chemical Identifiers
| CAS Number | 27696-24-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)[O-].C1=CC=C(C=C1)[O-].[Ba+2] |
| InChIKey | HMOHOVASWYMMHA-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, barium salt (2:1) (CAS 27696-24-8), with molecular formula C12H10BaO2 and molecular weight 323.97 g/mol. IUPAC: barium(2+) diphenoxide.
Chemical Property Profile of Phenol, barium salt (2:1)
Property Insights of Phenol, barium salt (2:1)
The XLogP value of 1.1396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, barium salt (2:1). With a topological polar surface area (TPSA) of 46.1 Ų, Phenol, barium salt (2:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, barium salt (2:1) has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phenol, barium salt (2:1)?
The CAS number of Phenol, barium salt (2:1) is 27696-24-8.
What is the molecular formula of Phenol, barium salt (2:1)?
The molecular formula of Phenol, barium salt (2:1) is C12H10BaO2.
What is the molecular weight of Phenol, barium salt (2:1)?
The molecular weight of Phenol, barium salt (2:1) is 323.97 g/mol.
Where can I buy Phenol, barium salt (2:1)?
You can request a quote for Phenol, barium salt (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, barium salt (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Phenol, barium salt (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.