(5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate
TL;DR: (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate (CAS 19893-71-1) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-naphthalen-2-yl-4-nitropent-4-enyl) acetate
Also Known As: (5-naphthalen-2-yl-4-nitropent-4-enyl) acetate, [(E)-5-naphthalen-2-yl-4-nitropent-4-enyl] acetate, 5-(naphthalen-2-yl)-4-nitropent-4-en-1-yl acetate
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 19893-71-1 |
|---|---|
| SMILES | CC(=O)OCCCC(=CC1=CC2=CC=CC=C2C=C1)[N+](=O)[O-] |
| InChIKey | GRYDOKPJPSODRL-UHFFFAOYSA-N |
Product Overview
(5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate (CAS 19893-71-1), with molecular formula C17H17NO4 and molecular weight 299.12 g/mol. IUPAC: (5-naphthalen-2-yl-4-nitropent-4-enyl) acetate.
Chemical Property Profile of (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate
Property Insights of (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate
The XLogP value of 3.9 indicates that (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate 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 (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate. Following Lipinski's Rule of Five, (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate 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 (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate?
The CAS number of (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate is 19893-71-1.
What is the molecular formula of (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate?
The molecular formula of (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate is C17H17NO4.
What is the molecular weight of (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate?
The molecular weight of (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate is 299.12 g/mol.
Where can I buy (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate?
You can request a quote for (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (5-Naphthalen-2-yl-4-nitropent-4-enyl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.