7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole
TL;DR: 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole (CAS 108562-73-8) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole
Also Known As: 7-ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole, 2,1-Benzisoxazole, 7-ethyl-1,3-dihydro-3-methyl-, 2,1-Benzisoxazole, 1,3-dihydro-7-ethyl-3-methyl-
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 108562-73-8 |
|---|---|
| SMILES | CCC1=C2C(=CC=C1)C(ON2)C |
| InChIKey | URUINJUWSUBWNU-UHFFFAOYSA-N |
Product Overview
7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole (CAS 108562-73-8), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: 7-ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole.
Chemical Property Profile of 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole
Property Insights of 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole. With a topological polar surface area (TPSA) of 21.3 Ų, 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole 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 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole?
The CAS number of 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole is 108562-73-8.
What is the molecular formula of 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole?
The molecular formula of 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole is C10H13NO.
What is the molecular weight of 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole?
The molecular weight of 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole is 163.10 g/mol.
Where can I buy 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole?
You can request a quote for 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 7-Ethyl-3-methyl-1,3-dihydro-2,1-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.