2-Amino-4-prop-2-enylsulfinylbutanoic acid
TL;DR: 2-Amino-4-prop-2-enylsulfinylbutanoic acid (CAS 6958-79-8) is a chemical compound with molecular formula C7H13NO3S and molecular weight 191.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-prop-2-enylsulfinylbutanoic acid
Also Known As: 4-allylsulfinyl-2-amino-butyric acid, 4-Allylsulfinyl-2-amino-buttersaeure, 2-amino-4-prop-2-enylsulfinylbutanoic acid, 2-amino-4-(prop-2-en-1-ylsulfinyl)butanoic acid, 2-amino-4-prop-2-enylsulfinyl-butanoic acid
| Molecular Formula | C7H13NO3S |
|---|---|
| Molecular Weight | 191.06 g/mol |
| LogP | -3.2 |
| Topological Polar Surface Area | 99.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 191.06161 |
| Heavy Atoms | 12 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 6958-79-8 |
|---|---|
| SMILES | C=CCS(=O)CCC(C(=O)O)N |
| InChIKey | ZFPOSLRBOMJNCZ-UHFFFAOYSA-N |
Product Overview
2-Amino-4-prop-2-enylsulfinylbutanoic acid (CAS 6958-79-8), with molecular formula C7H13NO3S and molecular weight 191.06 g/mol. IUPAC: 2-amino-4-prop-2-enylsulfinylbutanoic acid.
Chemical Property Profile of 2-Amino-4-prop-2-enylsulfinylbutanoic acid
Property Insights of 2-Amino-4-prop-2-enylsulfinylbutanoic acid
The XLogP value of -3.2 indicates that 2-Amino-4-prop-2-enylsulfinylbutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-prop-2-enylsulfinylbutanoic acid. Following Lipinski's Rule of Five, 2-Amino-4-prop-2-enylsulfinylbutanoic acid has 2 hydrogen bond donor(s) and 5 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-Amino-4-prop-2-enylsulfinylbutanoic acid?
The CAS number of 2-Amino-4-prop-2-enylsulfinylbutanoic acid is 6958-79-8.
What is the molecular formula of 2-Amino-4-prop-2-enylsulfinylbutanoic acid?
The molecular formula of 2-Amino-4-prop-2-enylsulfinylbutanoic acid is C7H13NO3S.
What is the molecular weight of 2-Amino-4-prop-2-enylsulfinylbutanoic acid?
The molecular weight of 2-Amino-4-prop-2-enylsulfinylbutanoic acid is 191.06 g/mol.
Where can I buy 2-Amino-4-prop-2-enylsulfinylbutanoic acid?
You can request a quote for 2-Amino-4-prop-2-enylsulfinylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-4-prop-2-enylsulfinylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-4-prop-2-enylsulfinylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.