![3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid structure](/static/products/7599/7599-00-0.webp)
3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid
TL;DR: 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid (CAS 7599-00-0) is a chemical compound with molecular formula C19H20O6 and molecular weight 344.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-methoxy-4-phenylmethoxyphenyl)pentanedioic acid
Also Known As: 3-(3-methoxy-4-phenylmethoxyphenyl)pentanedioic acid, 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid, Pentanedioic acid, 3-[3-methoxy-4-(phenylmethoxy)phenyl]-
| Molecular Formula | C19H20O6 |
|---|---|
| Molecular Weight | 344.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 344.12598 |
| Heavy Atoms | 25 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 7599-00-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(CC(=O)O)CC(=O)O)OCC2=CC=CC=C2 |
| InChIKey | UFENVOPQAIEEQB-UHFFFAOYSA-N |
Product Overview
3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid (CAS 7599-00-0), with molecular formula C19H20O6 and molecular weight 344.13 g/mol. IUPAC: 3-(3-methoxy-4-phenylmethoxyphenyl)pentanedioic acid.
Chemical Property Profile of 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid
Property Insights of 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid. Following Lipinski's Rule of Five, 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic 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 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid?
The CAS number of 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid is 7599-00-0.
What is the molecular formula of 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid?
The molecular formula of 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid is C19H20O6.
What is the molecular weight of 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid?
The molecular weight of 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid is 344.13 g/mol.
Where can I buy 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid?
You can request a quote for 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(Benzyloxy)-3-methoxyphenyl]pentanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.