(1-Oxo-2(1H)-phthalazinyl)acetic acid
TL;DR: (1-Oxo-2(1H)-phthalazinyl)acetic acid (CAS 90689-39-7) is a chemical compound with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-oxophthalazin-2-yl)acetic acid
Also Known As: (1-oxophthalazin-2(1H)-yl)acetic acid, (1-Oxo-1H-phthalazin-2-yl)-acetic acid, 2-(1-oxophthalazin-2(1H)-yl)acetic acid, 2-(1-oxophthalazin-2-yl)acetic acid, (1-oxo-2(1h)-phthalazinyl)acetic acid
| Molecular Formula | C10H8N2O3 |
|---|---|
| Molecular Weight | 204.05 g/mol |
| LogP | 0.4811 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.0535 |
| Heavy Atoms | 15 |
| Complexity | 574.13434 |
Chemical Identifiers
| CAS Number | 90689-39-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)O |
Product Overview
(1-Oxo-2(1H)-phthalazinyl)acetic acid (CAS 90689-39-7), with molecular formula C10H8N2O3 and molecular weight 204.05 g/mol. IUPAC: 2-(1-oxophthalazin-2-yl)acetic acid.
Chemical Property Profile of (1-Oxo-2(1H)-phthalazinyl)acetic acid
Property Insights of (1-Oxo-2(1H)-phthalazinyl)acetic acid
The XLogP value of 0.4811 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Oxo-2(1H)-phthalazinyl)acetic acid. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for (1-Oxo-2(1H)-phthalazinyl)acetic acid. Following Lipinski's Rule of Five, (1-Oxo-2(1H)-phthalazinyl)acetic acid has 1 hydrogen bond donor(s) and 3 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 (1-Oxo-2(1H)-phthalazinyl)acetic acid?
The CAS number of (1-Oxo-2(1H)-phthalazinyl)acetic acid is 90689-39-7.
What is the molecular formula of (1-Oxo-2(1H)-phthalazinyl)acetic acid?
The molecular formula of (1-Oxo-2(1H)-phthalazinyl)acetic acid is C10H8N2O3.
What is the molecular weight of (1-Oxo-2(1H)-phthalazinyl)acetic acid?
The molecular weight of (1-Oxo-2(1H)-phthalazinyl)acetic acid is 204.05 g/mol.
Where can I buy (1-Oxo-2(1H)-phthalazinyl)acetic acid?
You can request a quote for (1-Oxo-2(1H)-phthalazinyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Oxo-2(1H)-phthalazinyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (1-Oxo-2(1H)-phthalazinyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.