胺菊酯
TL;DR: 胺菊酯 (CAS 7696-12-0) is a chemical compound with molecular formula C19H25NO4 and molecular weight 331.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
胺菊酯
(1,3-dioxo-4,5,6,7-tetrahydroisoindol-2-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Also Known As: Tetramethrin, Phthalthrin, Neo-pynamin, Bioneopynamin, Tetramethrine
| Molecular Formula | C19H25NO4 |
|---|---|
| Molecular Weight | 331.18 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.17834 |
| Heavy Atoms | 24 |
| Complexity | 639.0 |
| Melting Point | 68-70 °C |
| Boiling Point | 180-190 °C at 0.1 mm Hg |
| Density | 1.108 at 20 °C/20 °C |
| Solubility | Methanol (53 g/kg), hexane (20 g/kg), xylene (1 g/kg), acetone, toluene. |
| Vapor Pressure | 0.00000708 [mmHg] |
| Refractive Index | 1.5175 at 21.5 °C |
Chemical Identifiers
| CAS Number | 7696-12-0 |
|---|---|
| SMILES | CC(=CC1C(C1(C)C)C(=O)OCN2C(=O)C3=C(C2=O)CCCC3)C |
| InChIKey | CXBMCYHAMVGWJQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
胺菊酯 (CAS 7696-12-0), with molecular formula C19H25NO4 and molecular weight 331.18 g/mol. IUPAC: (1,3-dioxo-4,5,6,7-tetrahydroisoindol-2-yl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate.
Chemical Property Profile of 胺菊酯
Property Insights of 胺菊酯
The XLogP value of 4.7 indicates that 胺菊酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 胺菊酯. Following Lipinski's Rule of Five, 胺菊酯 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 胺菊酯?
The CAS number of 胺菊酯 is 7696-12-0.
What is the molecular formula of 胺菊酯?
The molecular formula of 胺菊酯 is C19H25NO4.
What is the molecular weight of 胺菊酯?
The molecular weight of 胺菊酯 is 331.18 g/mol.
Where can I buy 胺菊酯?
You can request a quote for 胺菊酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 胺菊酯?
Yes, KEHONG BIO provides custom synthesis services for 胺菊酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.