2-Benzoxazolinone, 3-(2-hydroxyethyl)-
TL;DR: 2-Benzoxazolinone, 3-(2-hydroxyethyl)- (CAS 26726-75-0) is a chemical compound with molecular formula C9H9NO3 and molecular weight 179.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxyethyl)-1,3-benzoxazol-2-one
Also Known As: N-Hydroxyethylbenzoxazolone, 3-(2-hydroxyethyl)-2,3-dihydro-1,3-benzoxazol-2-one, 2-BENZOXAZOLINONE, 3-(2-HYDROXYETHYL)-, 3-(2-Hydroxyethyl)-2-benzoxazolinone, 3-(2-Hydroxyethyl)benzoxazol-2(3H)-one
| Molecular Formula | C9H9NO3 |
|---|---|
| Molecular Weight | 179.06 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.05824 |
| Heavy Atoms | 13 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 26726-75-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C(=O)O2)CCO |
| InChIKey | LRLBEYAFJPUHME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Benzoxazolinone, 3-(2-hydroxyethyl)- (CAS 26726-75-0), with molecular formula C9H9NO3 and molecular weight 179.06 g/mol. IUPAC: 3-(2-hydroxyethyl)-1,3-benzoxazol-2-one.
Chemical Property Profile of 2-Benzoxazolinone, 3-(2-hydroxyethyl)-
Property Insights of 2-Benzoxazolinone, 3-(2-hydroxyethyl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzoxazolinone, 3-(2-hydroxyethyl)-. With a topological polar surface area (TPSA) of 49.8 Ų, 2-Benzoxazolinone, 3-(2-hydroxyethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzoxazolinone, 3-(2-hydroxyethyl)- 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 2-Benzoxazolinone, 3-(2-hydroxyethyl)-?
The CAS number of 2-Benzoxazolinone, 3-(2-hydroxyethyl)- is 26726-75-0.
What is the molecular formula of 2-Benzoxazolinone, 3-(2-hydroxyethyl)-?
The molecular formula of 2-Benzoxazolinone, 3-(2-hydroxyethyl)- is C9H9NO3.
What is the molecular weight of 2-Benzoxazolinone, 3-(2-hydroxyethyl)-?
The molecular weight of 2-Benzoxazolinone, 3-(2-hydroxyethyl)- is 179.06 g/mol.
Where can I buy 2-Benzoxazolinone, 3-(2-hydroxyethyl)-?
You can request a quote for 2-Benzoxazolinone, 3-(2-hydroxyethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzoxazolinone, 3-(2-hydroxyethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoxazolinone, 3-(2-hydroxyethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.