![3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine structure](/static/products/7444/74444-57-8.webp)
3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine
TL;DR: 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine (CAS 74444-57-8) is a chemical compound with molecular formula C13H13NO and molecular weight 199.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2,4-dihydrobenzo[h][1,3]benzoxazine
Also Known As: 3-methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine, 3-methyl-2,4-dihydrobenzo[h][1,3]benzoxazine, 2,6-bis(benzyloxy)cyclohexa-2,5-diene-1,4-dione, 3-METHYL-2H,3H,4H-NAPHTHO[2,1-E][1,3]OXAZINE
| Molecular Formula | C13H13NO |
|---|---|
| Molecular Weight | 199.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.09972 |
| Heavy Atoms | 15 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 74444-57-8 |
|---|---|
| SMILES | CN1CC2=C(C3=CC=CC=C3C=C2)OC1 |
| InChIKey | OIUOFQJQYDMLMO-UHFFFAOYSA-N |
Product Overview
3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine (CAS 74444-57-8), with molecular formula C13H13NO and molecular weight 199.10 g/mol. IUPAC: 3-methyl-2,4-dihydrobenzo[h][1,3]benzoxazine.
Chemical Property Profile of 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine
Property Insights of 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine. With a topological polar surface area (TPSA) of 12.5 Ų, 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine 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 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine?
The CAS number of 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine is 74444-57-8.
What is the molecular formula of 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine?
The molecular formula of 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine is C13H13NO.
What is the molecular weight of 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine?
The molecular weight of 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine is 199.10 g/mol.
Where can I buy 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine?
You can request a quote for 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-3,4-dihydro-2h-naphtho[2,1-e][1,3]oxazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.