![3[S]-Phenylvaleric acid structure](/static/products/164/16460-78-9.png)
3[S]-Phenylvaleric acid
TL;DR: 3[S]-Phenylvaleric acid (CAS 16460-78-9) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-phenylpentanoic acid
Also Known As: Trimethylhydroxylamine, 3[S]-Phenylvaleric acid, (3S)-3-phenylpentanoic acid, (s)-3-phenylpentanoic acid, [S,(+)]-3-Phenylvaleric acid
| Molecular Formula | C11H14O2 |
|---|---|
| Molecular Weight | 178.10 g/mol |
| LogP | 2.6549 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 178.09938 |
| Heavy Atoms | 13 |
| Complexity | 266.6786 |
Chemical Identifiers
| CAS Number | 16460-78-9 |
|---|---|
| SMILES | CC[C@@H](CC(=O)O)C1=CC=CC=C1 |
Product Overview
3[S]-Phenylvaleric acid (CAS 16460-78-9), with molecular formula C11H14O2 and molecular weight 178.10 g/mol. IUPAC: (3S)-3-phenylpentanoic acid.
Chemical Property Profile of 3[S]-Phenylvaleric acid
Property Insights of 3[S]-Phenylvaleric acid
The XLogP value of 2.6549 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3[S]-Phenylvaleric acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3[S]-Phenylvaleric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3[S]-Phenylvaleric acid has 1 hydrogen bond donor(s) and 1 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[S]-Phenylvaleric acid?
The CAS number of 3[S]-Phenylvaleric acid is 16460-78-9.
What is the molecular formula of 3[S]-Phenylvaleric acid?
The molecular formula of 3[S]-Phenylvaleric acid is C11H14O2.
What is the molecular weight of 3[S]-Phenylvaleric acid?
The molecular weight of 3[S]-Phenylvaleric acid is 178.10 g/mol.
Where can I buy 3[S]-Phenylvaleric acid?
You can request a quote for 3[S]-Phenylvaleric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3[S]-Phenylvaleric acid?
Yes, KEHONG BIO provides custom synthesis services for 3[S]-Phenylvaleric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.