DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine
TL;DR: DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine (CAS 25684-28-0) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-3,4-dihydro-2H-1,5-benzoxazocin-3-ol
Also Known As: Compound 15219, DL-3,4-Dihydro-3-hydroxy-6-methyl-1,5-benzoxazocine, (+-)-6-Methyl-3,4-dihydro-2H-1,5-benzoxazocin-3-ol, 6-methyl-3,4-dihydro-2H-1,5-benzoxazocin-3-ol, DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 41.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 25684-28-0 |
|---|---|
| SMILES | CC1=NCC(COC2=CC=CC=C12)O |
| InChIKey | BGEPNKVWVGTOLC-UHFFFAOYSA-N |
Product Overview
DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine (CAS 25684-28-0), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: 6-methyl-3,4-dihydro-2H-1,5-benzoxazocin-3-ol.
Chemical Property Profile of DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine
Property Insights of DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine. With a topological polar surface area (TPSA) of 41.8 Ų, DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine has 1 hydrogen bond donor(s) and 3 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 DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine?
The CAS number of DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine is 25684-28-0.
What is the molecular formula of DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine?
The molecular formula of DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine is C11H13NO2.
What is the molecular weight of DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine?
The molecular weight of DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine is 191.09 g/mol.
Where can I buy DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine?
You can request a quote for DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine?
Yes, KEHONG BIO provides custom synthesis services for DL-3-hydroxy-6-methyl-3,4-dihydro-1,5-benzoxazocine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.