Nemorensine
TL;DR: Nemorensine (CAS 50907-07-8) is a chemical compound with molecular formula C17H21NO4 and molecular weight 303.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Also Known As: Nemorensine, (4-nitrophenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate, 2-(2-Methyl-1-propenyl)-3,3-dimethylcyclopropane-1-carboxylic acid 4-nitrobenzyl ester, 4-Nitrophenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate, (4-NITROPHENYL)METHYL 2,2-DIMETHYL-3-(2-METHYLPROP-1-EN-1-YL)CYCLOPROPANE-1-CARBOXYLATE
| Molecular Formula | C17H21NO4 |
|---|---|
| Molecular Weight | 303.15 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.14706 |
| Heavy Atoms | 22 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 50907-07-8 |
|---|---|
| SMILES | CC(=CC1C(C1(C)C)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C |
| InChIKey | MYPBCHKEKSZNSG-UHFFFAOYSA-N |
Product Overview
Nemorensine (CAS 50907-07-8), with molecular formula C17H21NO4 and molecular weight 303.15 g/mol. IUPAC: (4-nitrophenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate.
Chemical Property Profile of Nemorensine
Property Insights of Nemorensine
The XLogP value of 5.3 indicates that Nemorensine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Nemorensine. Following Lipinski's Rule of Five, Nemorensine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nemorensine?
The CAS number of Nemorensine is 50907-07-8.
What is the molecular formula of Nemorensine?
The molecular formula of Nemorensine is C17H21NO4.
What is the molecular weight of Nemorensine?
The molecular weight of Nemorensine is 303.15 g/mol.
Where can I buy Nemorensine?
You can request a quote for Nemorensine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nemorensine?
Yes, KEHONG BIO provides custom synthesis services for Nemorensine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.