(5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate
TL;DR: (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate (CAS 19893-70-0) is a chemical compound with molecular formula C22H21NO4 and molecular weight 363.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-nitro-6-phenanthren-9-ylhex-5-enyl) acetate
Also Known As: (5-nitro-6-phenanthren-9-ylhex-5-enyl) acetate, [(Z)-5-nitro-6-phenanthren-9-ylhex-5-enyl] acetate, 5-nitro-6-(phenanthren-9-yl)hex-5-en-1-yl acetate
| Molecular Formula | C22H21NO4 |
|---|---|
| Molecular Weight | 363.15 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 363.14706 |
| Heavy Atoms | 27 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 19893-70-0 |
|---|---|
| SMILES | CC(=O)OCCCCC(=CC1=CC2=CC=CC=C2C3=CC=CC=C31)[N+](=O)[O-] |
| InChIKey | ZPDYAHMIKLXMBU-UHFFFAOYSA-N |
Product Overview
(5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate (CAS 19893-70-0), with molecular formula C22H21NO4 and molecular weight 363.15 g/mol. IUPAC: (5-nitro-6-phenanthren-9-ylhex-5-enyl) acetate.
Chemical Property Profile of (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate
Property Insights of (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate
The XLogP value of 5.6 indicates that (5-Nitro-6-phenanthren-9-ylhex-5-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-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate. Following Lipinski's Rule of Five, (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate 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 (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate?
The CAS number of (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate is 19893-70-0.
What is the molecular formula of (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate?
The molecular formula of (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate is C22H21NO4.
What is the molecular weight of (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate?
The molecular weight of (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate is 363.15 g/mol.
Where can I buy (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate?
You can request a quote for (5-Nitro-6-phenanthren-9-ylhex-5-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-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (5-Nitro-6-phenanthren-9-ylhex-5-enyl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.