(R)-3-Butene-1,2-diol-1-(p-toluenesulfonate)
TL;DR: (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate) (CAS 138249-07-7) is a chemical compound with molecular formula C11H14O4S and molecular weight 242.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate
Also Known As: (R)-1-Tosyloxy-3-buten-2-ol, (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate), (R)-2-Hydroxy-3-butenyl tosylate, (R)-3-Butene-1,2-diol 1-tosylate, -1-TOSYLOXY-3-BUTEN-2-OL
| Molecular Formula | C11H14O4S |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 1.24722 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.06128 |
| Heavy Atoms | 16 |
| Complexity | 447.37784 |
Chemical Identifiers
| CAS Number | 138249-07-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H](C=C)O |
Product Overview
(R)-3-Butene-1,2-diol-1-(p-toluenesulfonate) (CAS 138249-07-7), with molecular formula C11H14O4S and molecular weight 242.06 g/mol. IUPAC: [(2R)-2-hydroxybut-3-enyl] 4-methylbenzenesulfonate.
Chemical Property Profile of (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate)
Property Insights of (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate)
The XLogP value of 1.24722 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate). The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate). Following Lipinski's Rule of Five, (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate) has 1 hydrogen bond donor(s) and 4 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 (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate)?
The CAS number of (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate) is 138249-07-7.
What is the molecular formula of (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate)?
The molecular formula of (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate) is C11H14O4S.
What is the molecular weight of (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate)?
The molecular weight of (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate) is 242.06 g/mol.
Where can I buy (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate)?
You can request a quote for (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate)?
Yes, KEHONG BIO provides custom synthesis services for (R)-3-Butene-1,2-diol-1-(p-toluenesulfonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.