6-methyl-3,4-dihydro-2H-1,4-benzoxazine
TL;DR: 6-methyl-3,4-dihydro-2H-1,4-benzoxazine (CAS 71472-57-6) is a chemical compound with molecular formula C9H11NO and molecular weight 149.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-3,4-dihydro-2H-1,4-benzoxazine
Also Known As: 6-methyl-3,4-dihydro-2H-1,4-benzoxazine, 2H-1,4-Benzoxazine, 3,4-dihydro-6-methyl-, ASN 07153870, 6-Methyl-3,4-dihydro-2H-benzo[1,4]oxazine, 6-METHYL-3,4-DIHYDRO-2H-1,4BEZOXAZINE
| Molecular Formula | C9H11NO |
|---|---|
| Molecular Weight | 149.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 149.08406 |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 71472-57-6 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OCCN2 |
| InChIKey | VKWQSTIJYWQSAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-methyl-3,4-dihydro-2H-1,4-benzoxazine (CAS 71472-57-6), with molecular formula C9H11NO and molecular weight 149.08 g/mol. IUPAC: 6-methyl-3,4-dihydro-2H-1,4-benzoxazine.
Chemical Property Profile of 6-methyl-3,4-dihydro-2H-1,4-benzoxazine
Property Insights of 6-methyl-3,4-dihydro-2H-1,4-benzoxazine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-methyl-3,4-dihydro-2H-1,4-benzoxazine. With a topological polar surface area (TPSA) of 21.3 Ų, 6-methyl-3,4-dihydro-2H-1,4-benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-methyl-3,4-dihydro-2H-1,4-benzoxazine has 1 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 6-methyl-3,4-dihydro-2H-1,4-benzoxazine?
The CAS number of 6-methyl-3,4-dihydro-2H-1,4-benzoxazine is 71472-57-6.
What is the molecular formula of 6-methyl-3,4-dihydro-2H-1,4-benzoxazine?
The molecular formula of 6-methyl-3,4-dihydro-2H-1,4-benzoxazine is C9H11NO.
What is the molecular weight of 6-methyl-3,4-dihydro-2H-1,4-benzoxazine?
The molecular weight of 6-methyl-3,4-dihydro-2H-1,4-benzoxazine is 149.08 g/mol.
Where can I buy 6-methyl-3,4-dihydro-2H-1,4-benzoxazine?
You can request a quote for 6-methyl-3,4-dihydro-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 6-methyl-3,4-dihydro-2H-1,4-benzoxazine?
Yes, KEHONG BIO provides custom synthesis services for 6-methyl-3,4-dihydro-2H-1,4-benzoxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.