Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-
TL;DR: Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)- (CAS 89228-66-0) is a chemical compound with molecular formula C10H9NO4 and molecular weight 207.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-4-nitro-2-prop-2-ynoxybenzene
Also Known As: Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-, 1-methoxy-4-nitro-2-prop-2-ynoxybenzene, 1-methoxy-4-nitro-2-(prop-2-yn-1-yloxy)benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)benzene, 1-methoxy-4-nitro-2-prop-2-ynoxy-benzene
| Molecular Formula | C10H9NO4 |
|---|---|
| Molecular Weight | 207.05 g/mol |
| LogP | 1.6154 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.05316 |
| Heavy Atoms | 15 |
| Complexity | 408.3737 |
Chemical Identifiers
| CAS Number | 89228-66-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])OCC#C |
Product Overview
Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)- (CAS 89228-66-0), with molecular formula C10H9NO4 and molecular weight 207.05 g/mol. IUPAC: 1-methoxy-4-nitro-2-prop-2-ynoxybenzene.
Chemical Property Profile of Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-
Property Insights of Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-
The XLogP value of 1.6154 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-. Following Lipinski's Rule of Five, Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)- 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 Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-?
The CAS number of Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)- is 89228-66-0.
What is the molecular formula of Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-?
The molecular formula of Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)- is C10H9NO4.
What is the molecular weight of Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-?
The molecular weight of Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)- is 207.05 g/mol.
Where can I buy Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-?
You can request a quote for Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.