1,3-Benzodioxole, 5-methoxy-6-nitro-
TL;DR: 1,3-Benzodioxole, 5-methoxy-6-nitro- (CAS 10310-02-8) is a chemical compound with molecular formula C8H7NO5 and molecular weight 197.03242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methoxy-6-nitro-1,3-benzodioxole
Also Known As: 5-methoxy-6-nitro-1,3-benzodioxole, 5-Methoxy-6-nitrobenzo[d][1,3]dioxole, 1,3-BENZODIOXOLE, 5-METHOXY-6-NITRO-, 6-Methoxy-5-nitro-1,3-benzodioxole, 5-METHOXY-6-NITRO-2H-1,3-BENZODIOXOLE
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H7NO5 |
| Molecular Weight | 197.03242 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 73.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 197.03242 Da |
| Heavy Atoms | 14 |
| Complexity | 228.0 |
| SMILES | COC1=CC2=C(C=C1[N+](=O)[O-])OCO2 |
| InChIKey | PSDYVDORVSBOQW-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Benzodioxole, 5-methoxy-6-nitro-
Property Insights of 1,3-Benzodioxole, 5-methoxy-6-nitro-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzodioxole, 5-methoxy-6-nitro-. The TPSA of 73.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzodioxole, 5-methoxy-6-nitro-. Following Lipinski's Rule of Five, 1,3-Benzodioxole, 5-methoxy-6-nitro- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3-Benzodioxole, 5-methoxy-6-nitro-?
The CAS number of 1,3-Benzodioxole, 5-methoxy-6-nitro- is 10310-02-8.
What is the molecular formula of 1,3-Benzodioxole, 5-methoxy-6-nitro-?
The molecular formula of 1,3-Benzodioxole, 5-methoxy-6-nitro- is C8H7NO5.
What is the molecular weight of 1,3-Benzodioxole, 5-methoxy-6-nitro-?
The molecular weight of 1,3-Benzodioxole, 5-methoxy-6-nitro- is 197.03242 g/mol.
Where can I buy 1,3-Benzodioxole, 5-methoxy-6-nitro-?
You can request a quote for 1,3-Benzodioxole, 5-methoxy-6-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Benzodioxole, 5-methoxy-6-nitro-?
Yes, CoreyChem provides custom synthesis services for 1,3-Benzodioxole, 5-methoxy-6-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.