(2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1)
TL;DR: (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) (CAS 98094-77-0) is a chemical compound with molecular formula C12H15NO6 and molecular weight 269.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoethanol;2-[(2-hydroxyphenyl)methylidene]propanedioic acid
Also Known As: 2-aminoethanol, KST-1A9216, (2-hydroxybenzylidene)propanedioic acid- 2-aminoethanol(1:1), 2-aminoethanol,2-[(2-hydroxyphenyl)methylidene]propanedioic acid, 2-aminoethanol; 2-[(2-hydroxyphenyl)methylidene]propanedioic acid
| Molecular Formula | C12H15NO6 |
|---|---|
| Molecular Weight | 269.09 g/mol |
| LogP | -0.1178 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.08994 |
| Heavy Atoms | 19 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 98094-77-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=C(C(=O)O)C(=O)O)O.C(CO)N |
| InChIKey | KKSNLUODLLYPTB-UHFFFAOYSA-N |
Product Overview
(2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) (CAS 98094-77-0), with molecular formula C12H15NO6 and molecular weight 269.09 g/mol. IUPAC: 2-aminoethanol;2-[(2-hydroxyphenyl)methylidene]propanedioic acid.
Chemical Property Profile of (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1)
Property Insights of (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1)
The XLogP value of -0.1178 indicates that (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.0 Ų indicates high polarity, suggesting (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) has 5 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 (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1)?
The CAS number of (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) is 98094-77-0.
What is the molecular formula of (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1)?
The molecular formula of (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) is C12H15NO6.
What is the molecular weight of (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1)?
The molecular weight of (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) is 269.09 g/mol.
Where can I buy (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1)?
You can request a quote for (2-Hydroxybenzylidene)propanedioic acid-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 (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1)?
Yes, KEHONG BIO provides custom synthesis services for (2-Hydroxybenzylidene)propanedioic acid-2-aminoethanol(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.