2-Hydroxyethyl hydrogen phthalate
TL;DR: 2-Hydroxyethyl hydrogen phthalate (CAS 17689-42-8) is a chemical compound with molecular formula C10H10O5 and molecular weight 210.05283 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-hydroxyethoxycarbonyl)benzoic acid
Also Known As: 2-((2-Hydroxyethoxy)carbonyl)benzoic acid, 2-Hydroxyethyl hydrogen phthalate, 2-[(2-hydroxyethoxy)carbonyl]benzoic acid, 2-(2-hydroxyethoxycarbonyl)benzoic acid, Butylphthalide Impurity 51
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H10O5 |
| Molecular Weight | 210.05283 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 210.05283 Da |
| Heavy Atoms | 15 |
| Complexity | 238.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)C(=O)OCCO |
| InChIKey | NTINFTOOVNKGIU-UHFFFAOYSA-N |
Chemical Property Profile of 2-Hydroxyethyl hydrogen phthalate
Property Insights of 2-Hydroxyethyl hydrogen phthalate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyethyl hydrogen phthalate. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxyethyl hydrogen phthalate. Following Lipinski's Rule of Five, 2-Hydroxyethyl hydrogen phthalate 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
What is the CAS number of 2-Hydroxyethyl hydrogen phthalate?
The CAS number of 2-Hydroxyethyl hydrogen phthalate is 17689-42-8.
What is the molecular formula of 2-Hydroxyethyl hydrogen phthalate?
The molecular formula of 2-Hydroxyethyl hydrogen phthalate is C10H10O5.
What is the molecular weight of 2-Hydroxyethyl hydrogen phthalate?
The molecular weight of 2-Hydroxyethyl hydrogen phthalate is 210.05283 g/mol.
Where can I buy 2-Hydroxyethyl hydrogen phthalate?
You can request a quote for 2-Hydroxyethyl hydrogen phthalate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Hydroxyethyl hydrogen phthalate?
Yes, CoreyChem provides custom synthesis services for 2-Hydroxyethyl hydrogen phthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.