3-(Benzenesulfonyl)-4-methoxybutan-2-one
TL;DR: 3-(Benzenesulfonyl)-4-methoxybutan-2-one (CAS 133834-07-8) 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.
3-(benzenesulfonyl)-4-methoxybutan-2-one
Also Known As: 3-(Benzenesulfonyl)-4-methoxy-2-butanone, 3-(benzenesulfonyl)-4-methoxybutan-2-one, 3-(benzenesulfonyl)-4-methoxy-butan-2-one
| Molecular Formula | C11H14O4S |
|---|---|
| Molecular Weight | 242.06 g/mol |
| LogP | 1.0643 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 242.06128 |
| Heavy Atoms | 16 |
| Complexity | 450.13272 |
Chemical Identifiers
| CAS Number | 133834-07-8 |
|---|---|
| SMILES | CC(=O)C(COC)S(=O)(=O)C1=CC=CC=C1 |
Product Overview
3-(Benzenesulfonyl)-4-methoxybutan-2-one (CAS 133834-07-8), with molecular formula C11H14O4S and molecular weight 242.06 g/mol. IUPAC: 3-(benzenesulfonyl)-4-methoxybutan-2-one.
Chemical Property Profile of 3-(Benzenesulfonyl)-4-methoxybutan-2-one
Property Insights of 3-(Benzenesulfonyl)-4-methoxybutan-2-one
The XLogP value of 1.0643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Benzenesulfonyl)-4-methoxybutan-2-one. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Benzenesulfonyl)-4-methoxybutan-2-one. Following Lipinski's Rule of Five, 3-(Benzenesulfonyl)-4-methoxybutan-2-one 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 3-(Benzenesulfonyl)-4-methoxybutan-2-one?
The CAS number of 3-(Benzenesulfonyl)-4-methoxybutan-2-one is 133834-07-8.
What is the molecular formula of 3-(Benzenesulfonyl)-4-methoxybutan-2-one?
The molecular formula of 3-(Benzenesulfonyl)-4-methoxybutan-2-one is C11H14O4S.
What is the molecular weight of 3-(Benzenesulfonyl)-4-methoxybutan-2-one?
The molecular weight of 3-(Benzenesulfonyl)-4-methoxybutan-2-one is 242.06 g/mol.
Where can I buy 3-(Benzenesulfonyl)-4-methoxybutan-2-one?
You can request a quote for 3-(Benzenesulfonyl)-4-methoxybutan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Benzenesulfonyl)-4-methoxybutan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(Benzenesulfonyl)-4-methoxybutan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.