二丁基氨基磺酸
TL;DR: 二丁基氨基磺酸 (CAS 90225-81-3) is a chemical compound with molecular formula C8H19NO3S and molecular weight 209.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二丁基氨基磺酸
dibutylsulfamic acid
Also Known As: Dibutylsulfamic acid, Dibutylsulfaminsaure, N,N-dibutylsulfamic acid, 1-(butyl-sulfo-amino)butane, J1.397.989H
| Molecular Formula | C8H19NO3S |
|---|---|
| Molecular Weight | 209.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 209.10857 |
| Heavy Atoms | 13 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 90225-81-3 |
|---|---|
| SMILES | CCCCN(CCCC)S(=O)(=O)O |
| InChIKey | BAQKWXACUNEBOT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二丁基氨基磺酸 (CAS 90225-81-3), with molecular formula C8H19NO3S and molecular weight 209.11 g/mol. IUPAC: dibutylsulfamic acid.
Chemical Property Profile of 二丁基氨基磺酸
Property Insights of 二丁基氨基磺酸
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二丁基氨基磺酸. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 二丁基氨基磺酸. Following Lipinski's Rule of Five, 二丁基氨基磺酸 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 二丁基氨基磺酸?
The CAS number of 二丁基氨基磺酸 is 90225-81-3.
What is the molecular formula of 二丁基氨基磺酸?
The molecular formula of 二丁基氨基磺酸 is C8H19NO3S.
What is the molecular weight of 二丁基氨基磺酸?
The molecular weight of 二丁基氨基磺酸 is 209.11 g/mol.
Where can I buy 二丁基氨基磺酸?
You can request a quote for 二丁基氨基磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二丁基氨基磺酸?
Yes, KEHONG BIO provides custom synthesis services for 二丁基氨基磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.