丁磺酸
TL;DR: 丁磺酸 (CAS 2386-47-2) is a chemical compound with molecular formula C4H10O3S and molecular weight 138.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁磺酸
butane-1-sulfonic acid
Also Known As: 1-Butanesulfonic acid, butane-1-sulfonic acid, butanesulfonic acid, butane sulfonic acid, Butane-1-sulphonic acid
| Molecular Formula | C4H10O3S |
|---|---|
| Molecular Weight | 138.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 138.03506 |
| Heavy Atoms | 8 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 2386-47-2 |
|---|---|
| SMILES | CCCCS(=O)(=O)O |
| InChIKey | QDHFHIQKOVNCNC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁磺酸 (CAS 2386-47-2), with molecular formula C4H10O3S and molecular weight 138.04 g/mol. IUPAC: butane-1-sulfonic acid.
Chemical Property Profile of 丁磺酸
Property Insights of 丁磺酸
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丁磺酸. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 丁磺酸. Following Lipinski's Rule of Five, 丁磺酸 has 1 hydrogen bond donor(s) and 3 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 丁磺酸?
The CAS number of 丁磺酸 is 2386-47-2.
What is the molecular formula of 丁磺酸?
The molecular formula of 丁磺酸 is C4H10O3S.
What is the molecular weight of 丁磺酸?
The molecular weight of 丁磺酸 is 138.04 g/mol.
Where can I buy 丁磺酸?
You can request a quote for 丁磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁磺酸?
Yes, KEHONG BIO provides custom synthesis services for 丁磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.