Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1)
TL;DR: Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) (CAS 64092-16-6) is a chemical compound with molecular formula C48H52CoN4O9 and molecular weight 887.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-benzoylbenzoate);cobalt(2+);bis(3-(1-methylpyrrolidin-2-yl)pyridine);trihydrate
Also Known As: Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1), Cobalt, bis(2-benzoylbenzoato-O(sup 1)bis(3-(1-methyl-2-pyrrolidinyl)pyridine-N(sup 1))-trihydrate, (T-4-(S),(S))-, Cobalt(2+) 2-benzoylbenzoate--3-(1-methylpyrrolidin-2-yl)pyridine--water (1/2/2/3), 2-benzoylbenzoate; cobalt(2+); 3-(1-methylpyrrolidin-2-yl)pyridine; trihydrate, RefChem:1082057
| Molecular Formula | C48H52CoN4O9 |
|---|---|
| Molecular Weight | 887.31 g/mol |
| LogP | 3.7822 |
| Topological Polar Surface Area | 241.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 887.30664 |
| Heavy Atoms | 62 |
| Complexity | 2093.1365 |
Chemical Identifiers
| CAS Number | 64092-16-6 |
|---|---|
| SMILES | CN1CCCC1C2=CN=CC=C2.CN1CCCC1C2=CN=CC=C2.C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)[O-].C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)[O-].O.O.O.[Co+2] |
Product Overview
Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) (CAS 64092-16-6), with molecular formula C48H52CoN4O9 and molecular weight 887.31 g/mol. IUPAC: bis(2-benzoylbenzoate);cobalt(2+);bis(3-(1-methylpyrrolidin-2-yl)pyridine);trihydrate.
Chemical Property Profile of Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1)
Property Insights of Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1)
The XLogP value of 3.7822 indicates that Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 241.16 Ų indicates high polarity, suggesting Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1)?
The CAS number of Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) is 64092-16-6.
What is the molecular formula of Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1)?
The molecular formula of Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) is C48H52CoN4O9.
What is the molecular weight of Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1)?
The molecular weight of Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) is 887.31 g/mol.
Where can I buy Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1)?
You can request a quote for Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Nicotine, compd. with cobalt(II) o-benzoyl-benzoate, trihydrate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.