Butyric acid, 3-amino-2-methyl-4-sulfo-
TL;DR: Butyric acid, 3-amino-2-methyl-4-sulfo- (CAS 33497-79-9) is a chemical compound with molecular formula C5H11NO5S and molecular weight 197.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-sulfoethylamino)propanoic acid
Also Known As: Tauropine, Rhodoic acid, N-(1-Carboxyethyl)taurine, D-Alanine,N-(2-sulfoethyl)-, D-Alanine, N-(2-sulfoethyl)-
| Molecular Formula | C5H11NO5S |
|---|---|
| Molecular Weight | 197.04 g/mol |
| LogP | -3.6 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 197.0358 |
| Heavy Atoms | 12 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 33497-79-9 |
|---|---|
| SMILES | CC(C(=O)O)NCCS(=O)(=O)O |
| InChIKey | VHYQDLYSULDZSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyric acid, 3-amino-2-methyl-4-sulfo- (CAS 33497-79-9), with molecular formula C5H11NO5S and molecular weight 197.04 g/mol. IUPAC: 2-(2-sulfoethylamino)propanoic acid.
Chemical Property Profile of Butyric acid, 3-amino-2-methyl-4-sulfo-
Property Insights of Butyric acid, 3-amino-2-methyl-4-sulfo-
The XLogP value of -3.6 indicates that Butyric acid, 3-amino-2-methyl-4-sulfo- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyric acid, 3-amino-2-methyl-4-sulfo-. Following Lipinski's Rule of Five, Butyric acid, 3-amino-2-methyl-4-sulfo- has 3 hydrogen bond donor(s) and 6 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 Butyric acid, 3-amino-2-methyl-4-sulfo-?
The CAS number of Butyric acid, 3-amino-2-methyl-4-sulfo- is 33497-79-9.
What is the molecular formula of Butyric acid, 3-amino-2-methyl-4-sulfo-?
The molecular formula of Butyric acid, 3-amino-2-methyl-4-sulfo- is C5H11NO5S.
What is the molecular weight of Butyric acid, 3-amino-2-methyl-4-sulfo-?
The molecular weight of Butyric acid, 3-amino-2-methyl-4-sulfo- is 197.04 g/mol.
Where can I buy Butyric acid, 3-amino-2-methyl-4-sulfo-?
You can request a quote for Butyric acid, 3-amino-2-methyl-4-sulfo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyric acid, 3-amino-2-methyl-4-sulfo-?
Yes, KEHONG BIO provides custom synthesis services for Butyric acid, 3-amino-2-methyl-4-sulfo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.