7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine
TL;DR: 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine (CAS 154264-95-6) is a chemical compound with molecular formula C9H10BrNO and molecular weight 226.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-bromo-4-methyl-2,3-dihydro-1,4-benzoxazine
Also Known As: 7-bromo-4-methyl-3,4-dihydro-2H-1,4-benzoxazine, 7-Bromo-4-methyl-3,4-dihydro-2H-benzo[b][1,4]oxazine, 7-bromo-4-methyl-2,3-dihydro-1,4-benzoxazine, 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine, 7-bromo-4-methyl-2H,3H-benzo[e]1,4-oxazine
| Molecular Formula | C9H10BrNO |
|---|---|
| Molecular Weight | 226.99 g/mol |
| LogP | 2.2777 |
| Topological Polar Surface Area | 12.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.99458 |
| Heavy Atoms | 12 |
| Complexity | 300.58005 |
Chemical Identifiers
| CAS Number | 154264-95-6 |
|---|---|
| SMILES | CN1CCOC2=C1C=CC(=C2)Br |
Product Overview
7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine (CAS 154264-95-6), with molecular formula C9H10BrNO and molecular weight 226.99 g/mol. IUPAC: 7-bromo-4-methyl-2,3-dihydro-1,4-benzoxazine.
Chemical Property Profile of 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine
Property Insights of 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine
The XLogP value of 2.2777 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine. With a topological polar surface area (TPSA) of 12.47 Ų, 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine has 0 hydrogen bond donor(s) and 2 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 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine?
The CAS number of 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine is 154264-95-6.
What is the molecular formula of 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine?
The molecular formula of 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine is C9H10BrNO.
What is the molecular weight of 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine?
The molecular weight of 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine is 226.99 g/mol.
Where can I buy 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine?
You can request a quote for 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 7-Bromo-3,4-dihydro-4-methyl-2H-1,4-benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.