4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate
TL;DR: 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate (CAS 10061-11-7) is a chemical compound with molecular formula C14H15N3O3 and molecular weight 273.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazol-1-ium nitrate
Also Known As: Naphthisen, Naphthizen, Vistalbalon, Imidazyl, Naftizin
| Molecular Formula | C14H15N3O3 |
|---|---|
| Molecular Weight | 273.11 g/mol |
| LogP | 1.12 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.11133 |
| Heavy Atoms | 20 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 10061-11-7 |
|---|---|
| SMILES | C1CN=C([NH2+]1)CC2=CC=CC3=CC=CC=C32.[N+](=O)([O-])[O-] |
| InChIKey | HZVHPACMMGWUIV-UHFFFAOYSA-O |
Product Overview
4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate (CAS 10061-11-7), with molecular formula C14H15N3O3 and molecular weight 273.11 g/mol. IUPAC: 2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazol-1-ium nitrate.
Chemical Property Profile of 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate
Property Insights of 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate
The XLogP value of 1.12 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate. Following Lipinski's Rule of Five, 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate has 1 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 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate?
The CAS number of 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate is 10061-11-7.
What is the molecular formula of 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate?
The molecular formula of 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate is C14H15N3O3.
What is the molecular weight of 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate?
The molecular weight of 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate is 273.11 g/mol.
Where can I buy 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate?
You can request a quote for 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dihydro-2-(1-naphthylmethyl)-1H-imidazolium nitrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.