![2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- structure](/static/products/5031/5031-74-3.webp)
2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-
TL;DR: 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- (CAS 5031-74-3) is a chemical compound with molecular formula C9H9NO5S and molecular weight 243.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-hydroxyethylsulfonyl)-3H-1,3-benzoxazol-2-one
Also Known As: 2(3h)-benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-, Vinyl sulphone Benzoxazolone, 6-[(2-Hydroxyethyl)sulfonyl]benzoxazol-2-(3H)one, 1,2-Benzenedisulfonyl dichloride, 6-(2-hydroxyethylsulfonyl)-3H-1,3-benzoxazol-2-one
| Molecular Formula | C9H9NO5S |
|---|---|
| Molecular Weight | 243.02 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.02014 |
| Heavy Atoms | 16 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 5031-74-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1S(=O)(=O)CCO)OC(=O)N2 |
| InChIKey | NLKFSULXKPSHMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- (CAS 5031-74-3), with molecular formula C9H9NO5S and molecular weight 243.02 g/mol. IUPAC: 6-(2-hydroxyethylsulfonyl)-3H-1,3-benzoxazol-2-one.
Chemical Property Profile of 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-
Property Insights of 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-
The XLogP value of -0.3 indicates that 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-. Following Lipinski's Rule of Five, 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- has 2 hydrogen bond donor(s) and 5 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(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-?
The CAS number of 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- is 5031-74-3.
What is the molecular formula of 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-?
The molecular formula of 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- is C9H9NO5S.
What is the molecular weight of 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-?
The molecular weight of 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- is 243.02 g/mol.
Where can I buy 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-?
You can request a quote for 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Benzoxazolone, 6-[(2-hydroxyethyl)sulfonyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.