4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde
TL;DR: 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde (CAS 141103-93-7) is a chemical compound with molecular formula C10H11NO2 and molecular weight 177.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-2,3-dihydro-1,4-benzoxazine-7-carbaldehyde
Also Known As: 4-Methyl-3,4-dihydro-2H-benzo[b][1,4]oxazine-7-carbaldehyde, 4-Methyl-3,4-Dihydro-2H-1,4-Benzoxazine-7-Carbaldehyde, 4-methyl-2,3-dihydro-1,4-benzoxazine-7-carbaldehyde, 2H-1,4-Benzoxazine-7-carboxaldehyde, 3,4-dihydro-4-methyl-, 4-Methyl-2,3-dihydro-2H-1,4-benzoxazine-7-carbaldehyde
Technical Specifications
| Molecular Formula | C10H11NO2 |
| Molecular Weight | 177.07898 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.07898 Da |
| Heavy Atoms | 13 |
| Complexity | 195.0 |
| SMILES | CN1CCOC2=C1C=CC(=C2)C=O |
| InChIKey | WJHBKMPLXRGBGM-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde
Property Insights of 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde. With a topological polar surface area (TPSA) of 29.5 Ų, 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde 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
What is the CAS number of 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde?
The CAS number of 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde is 141103-93-7.
What is the molecular formula of 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde?
The molecular formula of 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde is C10H11NO2.
What is the molecular weight of 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde?
The molecular weight of 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde is 177.07898 g/mol.
Where can I buy 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde?
You can request a quote for 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde?
Yes, CoreyChem provides custom synthesis services for 4-Methyl-3,4-dihydro-2H-1,4-benzoxazine-7-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.