![(2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid structure](/static/products/338/338945-92-9.png)
(2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid
TL;DR: (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid (CAS 338945-92-9) is a chemical compound with molecular formula C12H14O5 and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid
Also Known As: (S)-2-(3-Methoxybenzyl)succinic acid, 2-[(3-methoxyphenyl)methyl]butanedioic Acid, (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid, J1.507.828F
| Molecular Formula | C12H14O5 |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 238.08412 |
| Heavy Atoms | 17 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 338945-92-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C[C@@H](CC(=O)O)C(=O)O |
| InChIKey | FMZYGPLENOEZAC-VIFPVBQESA-N |
Product Overview
(2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid (CAS 338945-92-9), with molecular formula C12H14O5 and molecular weight 238.08 g/mol. IUPAC: (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid.
Chemical Property Profile of (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid
Property Insights of (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid. Following Lipinski's Rule of Five, (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid 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
Frequently Asked Questions
What is the CAS number of (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid?
The CAS number of (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid is 338945-92-9.
What is the molecular formula of (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid?
The molecular formula of (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid is C12H14O5.
What is the molecular weight of (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid?
The molecular weight of (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid is 238.08 g/mol.
Where can I buy (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid?
You can request a quote for (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-[(3-methoxyphenyl)methyl]butanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.