1-(2-Methoxyphenyl)-2-nitropropene
TL;DR: 1-(2-Methoxyphenyl)-2-nitropropene (CAS 69686-05-1) is a chemical compound with molecular formula C10H11NO3 and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-2-[(E)-2-nitroprop-1-enyl]benzene
Also Known As: Tetraacetyl-D-mannose, 1-(2-METHOXYPHENYL)-2-NITROPROPENE, (E)-1-Methoxy-2-(2-nitroprop-1-en-1-yl)benzene, 1-methoxy-2-(2-nitroprop-1-en-1-yl)benzene, 8705AB
| Molecular Formula | C10H11NO3 |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 2.3327 |
| Topological Polar Surface Area | 52.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.0739 |
| Heavy Atoms | 14 |
| Complexity | 371.3848 |
Chemical Identifiers
| CAS Number | 69686-05-1 |
|---|---|
| SMILES | C/C(=C\C1=CC=CC=C1OC)/[N+](=O)[O-] |
Product Overview
1-(2-Methoxyphenyl)-2-nitropropene (CAS 69686-05-1), with molecular formula C10H11NO3 and molecular weight 193.07 g/mol. IUPAC: 1-methoxy-2-[(E)-2-nitroprop-1-enyl]benzene.
Chemical Property Profile of 1-(2-Methoxyphenyl)-2-nitropropene
Property Insights of 1-(2-Methoxyphenyl)-2-nitropropene
The XLogP value of 2.3327 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Methoxyphenyl)-2-nitropropene. With a topological polar surface area (TPSA) of 52.37 Ų, 1-(2-Methoxyphenyl)-2-nitropropene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Methoxyphenyl)-2-nitropropene has 0 hydrogen bond donor(s) and 3 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 1-(2-Methoxyphenyl)-2-nitropropene?
The CAS number of 1-(2-Methoxyphenyl)-2-nitropropene is 69686-05-1.
What is the molecular formula of 1-(2-Methoxyphenyl)-2-nitropropene?
The molecular formula of 1-(2-Methoxyphenyl)-2-nitropropene is C10H11NO3.
What is the molecular weight of 1-(2-Methoxyphenyl)-2-nitropropene?
The molecular weight of 1-(2-Methoxyphenyl)-2-nitropropene is 193.07 g/mol.
Where can I buy 1-(2-Methoxyphenyl)-2-nitropropene?
You can request a quote for 1-(2-Methoxyphenyl)-2-nitropropene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Methoxyphenyl)-2-nitropropene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methoxyphenyl)-2-nitropropene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.