![2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid structure](/static/products/7475/7475-02-7.webp)
2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid
TL;DR: 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid (CAS 7475-02-7) is a chemical compound with molecular formula C12H10O6 and molecular weight 250.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-acetyloxyphenyl)methylidene]propanedioic acid
Also Known As: 2-[(2-acetyloxyphenyl)methylidene]propanedioic acid, {[2-(Acetyloxy)phenyl]methylidene}propanedioic acid
| Molecular Formula | C12H10O6 |
|---|---|
| Molecular Weight | 250.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.04774 |
| Heavy Atoms | 18 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 7475-02-7 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC=C1C=C(C(=O)O)C(=O)O |
| InChIKey | KKPBBYXBMUJZFQ-UHFFFAOYSA-N |
Product Overview
2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid (CAS 7475-02-7), with molecular formula C12H10O6 and molecular weight 250.05 g/mol. IUPAC: 2-[(2-acetyloxyphenyl)methylidene]propanedioic acid.
Chemical Property Profile of 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid
Property Insights of 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid. Following Lipinski's Rule of Five, 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid has 2 hydrogen bond donor(s) and 6 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-[(2-Acetyloxyphenyl)methylidene]propanedioic acid?
The CAS number of 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid is 7475-02-7.
What is the molecular formula of 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid?
The molecular formula of 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid is C12H10O6.
What is the molecular weight of 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid?
The molecular weight of 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid is 250.05 g/mol.
Where can I buy 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid?
You can request a quote for 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-Acetyloxyphenyl)methylidene]propanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.