Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)
TL;DR: Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) (CAS 36818-89-0) is a chemical compound with molecular formula C22H38CaO4 and molecular weight 406.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)
Also Known As: Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)calcium, Calcium (Z)-2,2,6,6-tetramethyl-5-oxo-hept-3-en-3-olate
| Molecular Formula | C22H38CaO4 |
|---|---|
| Molecular Weight | 406.24 g/mol |
| LogP | 3.403 |
| Topological Polar Surface Area | 80.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 406.2396 |
| Heavy Atoms | 27 |
| Complexity | 505.0811 |
Chemical Identifiers
| CAS Number | 36818-89-0 |
|---|---|
| SMILES | CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].[Ca+2] |
Product Overview
Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) (CAS 36818-89-0), with molecular formula C22H38CaO4 and molecular weight 406.24 g/mol. IUPAC: calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate).
Chemical Property Profile of Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)
Property Insights of Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)
The XLogP value of 3.403 indicates that Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.26 Ų falls within the moderate polarity range, balancing permeability and solubility for Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate). Following Lipinski's Rule of Five, Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) has 0 hydrogen bond donor(s) and 4 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 Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)?
The CAS number of Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) is 36818-89-0.
What is the molecular formula of Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)?
The molecular formula of Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) is C22H38CaO4.
What is the molecular weight of Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)?
The molecular weight of Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) is 406.24 g/mol.
Where can I buy Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)?
You can request a quote for Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate)?
Yes, KEHONG BIO provides custom synthesis services for Calcium bis(2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.