Einecs 248-922-4
TL;DR: Einecs 248-922-4 (CAS 28237-14-1) is a chemical compound with molecular formula C13H13NO2 and molecular weight 215.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-oxa-6-azatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),5,10,12-pentaen-2-ol
Also Known As: 5-methyl-4-oxa-6-azatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),5,10,12-pentaen-2-ol, 9,10-Dihydro-2-methyl-4H-benzo(5,6)cyclohept(1,2-d)oxazol-4-ol, 2-methyl-5,10-dihydro-4H-benzo[4,5]cyclohepta[1,2-d][1,3]oxazol-10-ol, EINECS 248-922-4
| Molecular Formula | C13H13NO2 |
|---|---|
| Molecular Weight | 215.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.09464 |
| Heavy Atoms | 16 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 28237-14-1 |
|---|---|
| SMILES | CC1=NC2=C(O1)C(C3=CC=CC=C3CC2)O |
| InChIKey | UTIRYRYPHRZIPA-UHFFFAOYSA-N |
Product Overview
Einecs 248-922-4 (CAS 28237-14-1), with molecular formula C13H13NO2 and molecular weight 215.09 g/mol. IUPAC: 5-methyl-4-oxa-6-azatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),5,10,12-pentaen-2-ol.
Chemical Property Profile of Einecs 248-922-4
Property Insights of Einecs 248-922-4
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 248-922-4. With a topological polar surface area (TPSA) of 46.3 Ų, Einecs 248-922-4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Einecs 248-922-4 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 Einecs 248-922-4?
The CAS number of Einecs 248-922-4 is 28237-14-1.
What is the molecular formula of Einecs 248-922-4?
The molecular formula of Einecs 248-922-4 is C13H13NO2.
What is the molecular weight of Einecs 248-922-4?
The molecular weight of Einecs 248-922-4 is 215.09 g/mol.
Where can I buy Einecs 248-922-4?
You can request a quote for Einecs 248-922-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 248-922-4?
Yes, KEHONG BIO provides custom synthesis services for Einecs 248-922-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.