3-Oxo-3-phenylpropane-1-sulfinic acid
TL;DR: 3-Oxo-3-phenylpropane-1-sulfinic acid (CAS 65373-84-4) is a chemical compound with molecular formula C9H10O3S and molecular weight 198.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxo-3-phenylpropane-1-sulfinic acid
Also Known As: 3-oxo-3-phenylpropane-1-sulfinic acid, 3-Oxo-3-phenyl-propane-1-sulfinic acid, RefChem:281521
| Molecular Formula | C9H10O3S |
|---|---|
| Molecular Weight | 198.04 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 73.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 198.03506 |
| Heavy Atoms | 13 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 65373-84-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CCS(=O)O |
| InChIKey | MIYVFTAYOVTHPV-UHFFFAOYSA-N |
Product Overview
3-Oxo-3-phenylpropane-1-sulfinic acid (CAS 65373-84-4), with molecular formula C9H10O3S and molecular weight 198.04 g/mol. IUPAC: 3-oxo-3-phenylpropane-1-sulfinic acid.
Chemical Property Profile of 3-Oxo-3-phenylpropane-1-sulfinic acid
Property Insights of 3-Oxo-3-phenylpropane-1-sulfinic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Oxo-3-phenylpropane-1-sulfinic acid. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Oxo-3-phenylpropane-1-sulfinic acid. Following Lipinski's Rule of Five, 3-Oxo-3-phenylpropane-1-sulfinic acid 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 3-Oxo-3-phenylpropane-1-sulfinic acid?
The CAS number of 3-Oxo-3-phenylpropane-1-sulfinic acid is 65373-84-4.
What is the molecular formula of 3-Oxo-3-phenylpropane-1-sulfinic acid?
The molecular formula of 3-Oxo-3-phenylpropane-1-sulfinic acid is C9H10O3S.
What is the molecular weight of 3-Oxo-3-phenylpropane-1-sulfinic acid?
The molecular weight of 3-Oxo-3-phenylpropane-1-sulfinic acid is 198.04 g/mol.
Where can I buy 3-Oxo-3-phenylpropane-1-sulfinic acid?
You can request a quote for 3-Oxo-3-phenylpropane-1-sulfinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxo-3-phenylpropane-1-sulfinic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxo-3-phenylpropane-1-sulfinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.