(5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate
TL;DR: (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate (CAS 58879-33-7) is a chemical compound with molecular formula C12H14O5S and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-oxooxolan-2-yl)methyl 4-methylbenzenesulfonate
Also Known As: SODIUMPHENOXIDE, (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate, 4,7-Dimethyl-1,10-phenanthroline, (S)-(5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate, (R)-(5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate
| Molecular Formula | C12H14O5S |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 1.40592 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.05618 |
| Heavy Atoms | 18 |
| Complexity | 532.0911 |
Chemical Identifiers
| CAS Number | 58879-33-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC2CCC(=O)O2 |
Product Overview
(5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate (CAS 58879-33-7), with molecular formula C12H14O5S and molecular weight 270.06 g/mol. IUPAC: (5-oxooxolan-2-yl)methyl 4-methylbenzenesulfonate.
Chemical Property Profile of (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate
Property Insights of (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate
The XLogP value of 1.40592 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate has 0 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 (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate?
The CAS number of (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate is 58879-33-7.
What is the molecular formula of (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate?
The molecular formula of (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate is C12H14O5S.
What is the molecular weight of (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate?
The molecular weight of (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate is 270.06 g/mol.
Where can I buy (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate?
You can request a quote for (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (5-Oxotetrahydrofuran-2-yl)methyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.