Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1)
TL;DR: Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) (CAS 102582-87-6) is a chemical compound with molecular formula C14H23NO7S and molecular weight 349.11954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(benzenesulfonyl)acetic acid;2-[bis(2-hydroxyethyl)amino]ethanol
Also Known As: (Phenylsulfonyl)acetic acid triethanolamine, (Phenylsulfonyl)acetic acid compd. with 2,2',2''-nitrilotrisethanol (1:1), ACETIC ACID, (PHENYLSULFONYL)-, compd. with 2,2',2''-NITRILOTRISETHANOL (1:1), 2-(benzenesulfonyl)acetic acid; 2-(bis(2-hydroxyethyl)amino)ethanol, (phenylsulfonyl)acetic acid-2,2',2''-nitrilotriethanol(1:1)
Technical Specifications
| Molecular Formula | C14H23NO7S |
| Molecular Weight | 349.11954 g/mol |
| XLogP | -1.19 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 349.11954 Da |
| Heavy Atoms | 23 |
| Complexity | 325.0 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)CC(=O)O.C(CO)N(CCO)CCO |
| InChIKey | GXLCWKVYXZJTBW-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1)
Property Insights of Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1)
The XLogP value of -1.19 indicates that Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1)?
The CAS number of Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) is 102582-87-6.
What is the molecular formula of Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1)?
The molecular formula of Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) is C14H23NO7S.
What is the molecular weight of Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1)?
The molecular weight of Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) is 349.11954 g/mol.
Where can I buy Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1)?
You can request a quote for Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1)?
Yes, CoreyChem provides custom synthesis services for Acetic acid, (phenylsulfonyl)-, compd. with 2,2',2''-nitrilotrisethanol (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.