Methyl 2-(naphthalen-2-ylsulfonyl)acetate
TL;DR: Methyl 2-(naphthalen-2-ylsulfonyl)acetate (CAS 80651-14-5) is a chemical compound with molecular formula C13H12O4S and molecular weight 264.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-naphthalen-2-ylsulfonylacetate
Also Known As: methyl 2-(naphthalen-2-ylsulfonyl)acetate, methyl 2-naphthalen-2-ylsulfonylacetate
| Molecular Formula | C13H12O4S |
|---|---|
| Molecular Weight | 264.05 g/mol |
| LogP | 1.7865 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.04562 |
| Heavy Atoms | 18 |
| Complexity | 688.9584 |
Chemical Identifiers
| CAS Number | 80651-14-5 |
|---|---|
| SMILES | COC(=O)CS(=O)(=O)C1=CC2=CC=CC=C2C=C1 |
Product Overview
Methyl 2-(naphthalen-2-ylsulfonyl)acetate (CAS 80651-14-5), with molecular formula C13H12O4S and molecular weight 264.05 g/mol. IUPAC: methyl 2-naphthalen-2-ylsulfonylacetate.
Chemical Property Profile of Methyl 2-(naphthalen-2-ylsulfonyl)acetate
Property Insights of Methyl 2-(naphthalen-2-ylsulfonyl)acetate
The XLogP value of 1.7865 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(naphthalen-2-ylsulfonyl)acetate. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(naphthalen-2-ylsulfonyl)acetate. Following Lipinski's Rule of Five, Methyl 2-(naphthalen-2-ylsulfonyl)acetate has 0 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 Methyl 2-(naphthalen-2-ylsulfonyl)acetate?
The CAS number of Methyl 2-(naphthalen-2-ylsulfonyl)acetate is 80651-14-5.
What is the molecular formula of Methyl 2-(naphthalen-2-ylsulfonyl)acetate?
The molecular formula of Methyl 2-(naphthalen-2-ylsulfonyl)acetate is C13H12O4S.
What is the molecular weight of Methyl 2-(naphthalen-2-ylsulfonyl)acetate?
The molecular weight of Methyl 2-(naphthalen-2-ylsulfonyl)acetate is 264.05 g/mol.
Where can I buy Methyl 2-(naphthalen-2-ylsulfonyl)acetate?
You can request a quote for Methyl 2-(naphthalen-2-ylsulfonyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(naphthalen-2-ylsulfonyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(naphthalen-2-ylsulfonyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.