![[(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid structure](/static/products/7512/7512-21-2.webp)
[(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid
TL;DR: [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid (CAS 7512-21-2) is a chemical compound with molecular formula C18H14O5 and molecular weight 310.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[anthracen-9-yl(hydroxy)methyl]propanedioic acid
Also Known As: [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid|2-[anthracen-9-yl(hydroxy)methyl]propanedioic acid|2-(anthracen-9-yl-hydroxy-methyl)propanedioic acid
| Molecular Formula | C18H14O5 |
|---|---|
| Molecular Weight | 310.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.08414 |
| Heavy Atoms | 23 |
| Complexity | 426.0 |
Chemical Identifiers
| CAS Number | 7512-21-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(C(C(=O)O)C(=O)O)O |
| InChIKey | VEEGYXRUTFERSX-UHFFFAOYSA-N |
Product Overview
[(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid (CAS 7512-21-2), with molecular formula C18H14O5 and molecular weight 310.08 g/mol. IUPAC: 2-[anthracen-9-yl(hydroxy)methyl]propanedioic acid.
Chemical Property Profile of [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid
Property Insights of [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid. Following Lipinski's Rule of Five, [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid has 3 hydrogen bond donor(s) and 5 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 [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid?
The CAS number of [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid is 7512-21-2.
What is the molecular formula of [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid?
The molecular formula of [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid is C18H14O5.
What is the molecular weight of [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid?
The molecular weight of [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid is 310.08 g/mol.
Where can I buy [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid?
You can request a quote for [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for [(Anthracen-9-yl)(hydroxy)methyl]propanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.