Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)
TL;DR: Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) (CAS 87298-88-2) is a chemical compound with molecular formula C11H25NO5S and molecular weight 283.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-hydroxyethyl)amino]ethanol;2-propylsulfanylacetic acid
Also Known As: (Propylthio)acetic acid 2,2',2''-nitrilotriethanol salt, ACETIC ACID, (PROPYLTHIO)-, compd. with 2,2',2''-NITRILOTRIS(ETHANOL) (1:1), 2-[bis(2-hydroxyethyl)amino]ethanol; 2-propylsulfanylacetic acid, 2-[bis(2-hydroxyethyl)amino]ethanol,2-propylsulfanylacetic acid, (Propylsulfanyl)acetic acid--2,2',2''-nitrilotri(ethan-1-ol) (1/1)
| Molecular Formula | C11H25NO5S |
|---|---|
| Molecular Weight | 283.15 g/mol |
| LogP | -0.52 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 283.14536 |
| Heavy Atoms | 18 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 87298-88-2 |
|---|---|
| SMILES | CCCSCC(=O)O.C(CO)N(CCO)CCO |
| InChIKey | QOARRBVZTGUCMV-UHFFFAOYSA-N |
Product Overview
Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) (CAS 87298-88-2), with molecular formula C11H25NO5S and molecular weight 283.15 g/mol. IUPAC: 2-[bis(2-hydroxyethyl)amino]ethanol;2-propylsulfanylacetic acid.
Chemical Property Profile of Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)
Property Insights of Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)
The XLogP value of -0.52 indicates that Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1). Following Lipinski's Rule of Five, Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) has 4 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 Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)?
The CAS number of Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) is 87298-88-2.
What is the molecular formula of Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)?
The molecular formula of Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) is C11H25NO5S.
What is the molecular weight of Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)?
The molecular weight of Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) is 283.15 g/mol.
Where can I buy Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)?
You can request a quote for Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (propylthio)-, compd. with 2,2',2''-nitrilotris(ethanol) (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.