6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde
TL;DR: 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde (CAS 149744-61-6) is a chemical compound with molecular formula C9H7NO5 and molecular weight 209.03242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-nitro-4H-1,3-benzodioxine-8-carbaldehyde
Also Known As: 6-nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde, 6-nitro-4H-1,3-benzodioxine-8-carbaldehyde, 6-nitro-4H-benzo[d][1,3]dioxine-8-carbaldehyde, 6-nitro-2H,4H-benzo[e]1,3-dioxin-8-carbaldehyde, F0019-0629
Technical Specifications
| Molecular Formula | C9H7NO5 |
| Molecular Weight | 209.03242 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.03242 Da |
| Heavy Atoms | 15 |
| Complexity | 264.0 |
| SMILES | C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=O)OCO1 |
| InChIKey | SUVYFXAZTWIGGZ-UHFFFAOYSA-N |
Chemical Property Profile of 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde
Property Insights of 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde. Following Lipinski's Rule of Five, 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde 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 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde?
The CAS number of 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde is 149744-61-6.
What is the molecular formula of 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde?
The molecular formula of 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde is C9H7NO5.
What is the molecular weight of 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde?
The molecular weight of 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde is 209.03242 g/mol.
Where can I buy 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde?
You can request a quote for 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 6-Nitro-2,4-dihydro-1,3-benzodioxine-8-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.