2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1)
TL;DR: 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1) (CAS 53621-34-4) is a chemical compound with molecular formula C6H13NO6S and molecular weight 227.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azane;2-sulfooxyethyl 2-methylprop-2-enoate
Also Known As: Ammonium 2-(sulphonatooxy)ethyl methacrylate, ammonium 2-(methacryloyloxy)ethyl sulfate, Sulfatoethyl methacrylate ammonium salt, 2-(sulfooxy)ethyl 2-methylacrylateammoniate, Ammonium 2-(sulfonatooxy)ethyl methacrylate
| Molecular Formula | C6H13NO6S |
|---|---|
| Molecular Weight | 227.05 g/mol |
| LogP | 0.09 |
| Topological Polar Surface Area | 99.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 227.04636 |
| Heavy Atoms | 14 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 53621-34-4 |
|---|---|
| SMILES | CC(=C)C(=O)OCCOS(=O)(=O)O.N |
| InChIKey | WCDLJSPFRWZKPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1) (CAS 53621-34-4), with molecular formula C6H13NO6S and molecular weight 227.05 g/mol. IUPAC: azane;2-sulfooxyethyl 2-methylprop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1)
Property Insights of 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1)
The XLogP value of 0.09 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1). The TPSA of 99.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1). Following Lipinski's Rule of Five, 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1) has 2 hydrogen bond donor(s) and 7 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 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1)?
The CAS number of 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1) is 53621-34-4.
What is the molecular formula of 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1)?
The molecular formula of 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1) is C6H13NO6S.
What is the molecular weight of 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1)?
The molecular weight of 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1) is 227.05 g/mol.
Where can I buy 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1)?
You can request a quote for 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 2-methyl-, 2-(sulfooxy)ethyl ester, ammonium salt (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.