Cobaltous benzoate
TL;DR: Cobaltous benzoate (CAS 7247-98-5) is a chemical compound with molecular formula C24H34O6 and molecular weight 418.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(7S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-7,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: COBALTOUS BENZOATE, KST-1A8998, (7, A,11, A)-11,17-dihydroxy-7-methyl-3,20-dioxopregn-4-en-21-yl acetate
| Molecular Formula | C24H34O6 |
|---|---|
| Molecular Weight | 418.24 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.23553 |
| Heavy Atoms | 30 |
| Complexity | 817.0 |
Chemical Identifiers
| CAS Number | 7247-98-5 |
|---|---|
| SMILES | C[C@H]1CC2=CC(=O)CC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@@]([C@]4(C[C@@H]3O)C)(C(=O)COC(=O)C)O)C |
| InChIKey | ZWFSSTRQQHGWAU-JIKNWKIHSA-N |
Product Overview
Cobaltous benzoate (CAS 7247-98-5), with molecular formula C24H34O6 and molecular weight 418.24 g/mol. IUPAC: [2-[(7S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-7,10,13-trimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of Cobaltous benzoate
Property Insights of Cobaltous benzoate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cobaltous benzoate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cobaltous benzoate. Following Lipinski's Rule of Five, Cobaltous benzoate has 2 hydrogen bond donor(s) and 6 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 Cobaltous benzoate?
The CAS number of Cobaltous benzoate is 7247-98-5.
What is the molecular formula of Cobaltous benzoate?
The molecular formula of Cobaltous benzoate is C24H34O6.
What is the molecular weight of Cobaltous benzoate?
The molecular weight of Cobaltous benzoate is 418.24 g/mol.
Where can I buy Cobaltous benzoate?
You can request a quote for Cobaltous benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cobaltous benzoate?
Yes, KEHONG BIO provides custom synthesis services for Cobaltous benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.