Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1)
TL;DR: Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) (CAS 64092-22-4) is a chemical compound with molecular formula C48H52MnN4O9 and molecular weight 883.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-benzoylbenzoate);manganese(2+);bis(3-(1-methylpyrrolidin-2-yl)pyridine);trihydrate
Also Known As: Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1), Manganese, bis(2-benzoylbenzoato)bis(3-(1-methyl-2-pyrrolidinyl)pyridine)-, trihydrate, Manganese(2+) 2-benzoylbenzoate--3-(1-methylpyrrolidin-2-yl)pyridine--water (1/2/2/3), 2-benzoylbenzoate; manganese(2+); 3-(1-methylpyrrolidin-2-yl)pyridine; trihydrate, Manganese, bis(2-benzoylbenzoato-O1)bis[3-(1-methyl-2-pyrrolidinyl)pyridine-N1]-, trihydrate
| Molecular Formula | C48H52MnN4O9 |
|---|---|
| Molecular Weight | 883.31 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 | 883.31146 |
| Heavy Atoms | 62 |
| Complexity | 2093.1365 |
Chemical Identifiers
| CAS Number | 64092-22-4 |
|---|---|
| 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.[Mn+2] |
Product Overview
Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) (CAS 64092-22-4), with molecular formula C48H52MnN4O9 and molecular weight 883.31 g/mol. IUPAC: bis(2-benzoylbenzoate);manganese(2+);bis(3-(1-methylpyrrolidin-2-yl)pyridine);trihydrate.
Chemical Property Profile of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1)
Property Insights of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1)
The XLogP value of 3.7822 indicates that Nicotine, compd. with manganese(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 manganese(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 manganese(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 manganese(II) o-benzoyl benzoate, trihydrate (2:1)?
The CAS number of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) is 64092-22-4.
What is the molecular formula of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1)?
The molecular formula of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) is C48H52MnN4O9.
What is the molecular weight of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1)?
The molecular weight of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) is 883.31 g/mol.
Where can I buy Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1)?
You can request a quote for Nicotine, compd. with manganese(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 manganese(II) o-benzoyl benzoate, trihydrate (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.