1-戊烷磺酸
TL;DR: 1-戊烷磺酸 (CAS 35452-30-3) is a chemical compound with molecular formula C5H12O3S and molecular weight 152.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-戊烷磺酸
pentane-1-sulfonic acid
Also Known As: 1-Pentanesulfonic acid, Butylmesylate, Pentane-1-sulfonic Acid, Sodium 1-pentanesulfonate, pentylsulfonate
| Molecular Formula | C5H12O3S |
|---|---|
| Molecular Weight | 152.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 152.05072 |
| Heavy Atoms | 9 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 35452-30-3 |
|---|---|
| SMILES | CCCCCS(=O)(=O)O |
| InChIKey | RJQRCOMHVBLQIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-戊烷磺酸 (CAS 35452-30-3), with molecular formula C5H12O3S and molecular weight 152.05 g/mol. IUPAC: pentane-1-sulfonic acid.
Chemical Property Profile of 1-戊烷磺酸
Property Insights of 1-戊烷磺酸
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-戊烷磺酸. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-戊烷磺酸. Following Lipinski's Rule of Five, 1-戊烷磺酸 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 1-戊烷磺酸?
The CAS number of 1-戊烷磺酸 is 35452-30-3.
What is the molecular formula of 1-戊烷磺酸?
The molecular formula of 1-戊烷磺酸 is C5H12O3S.
What is the molecular weight of 1-戊烷磺酸?
The molecular weight of 1-戊烷磺酸 is 152.05 g/mol.
Where can I buy 1-戊烷磺酸?
You can request a quote for 1-戊烷磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-戊烷磺酸?
Yes, KEHONG BIO provides custom synthesis services for 1-戊烷磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.