Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1)
TL;DR: Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) (CAS 70776-65-7) is a chemical compound with molecular formula C5H13NO3S and molecular weight 167.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethanol;3-sulfanylpropanoic acid
Also Known As: Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1), 2-aminoethanol; 3-sulfanylpropanoic acid, (2-Hydroxyethyl)ammonium 3-mercaptopropionate, 3-Mercaptopropionic acid, compound with 2-aminoethanol (1:1), 3-Sulfanylpropanoic acid--2-aminoethan-1-ol (1/1)
| Molecular Formula | C5H13NO3S |
|---|---|
| Molecular Weight | 167.06 g/mol |
| LogP | -0.6717 |
| Topological Polar Surface Area | 84.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 167.06161 |
| Heavy Atoms | 10 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 70776-65-7 |
|---|---|
| SMILES | C(CS)C(=O)O.C(CO)N |
| InChIKey | HPOPXQQVNOSELN-UHFFFAOYSA-N |
Product Overview
Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) (CAS 70776-65-7), with molecular formula C5H13NO3S and molecular weight 167.06 g/mol. IUPAC: 2-aminoethanol;3-sulfanylpropanoic acid.
Chemical Property Profile of Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1)
Property Insights of Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1)
The XLogP value of -0.6717 indicates that Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1). Following Lipinski's Rule of Five, Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) has 4 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 Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1)?
The CAS number of Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) is 70776-65-7.
What is the molecular formula of Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1)?
The molecular formula of Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) is C5H13NO3S.
What is the molecular weight of Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1)?
The molecular weight of Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) is 167.06 g/mol.
Where can I buy Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1)?
You can request a quote for Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 3-mercapto-, compd. with 2-aminoethanol (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.