3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid
TL;DR: 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid (CAS 6310-51-6) is a chemical compound with molecular formula C16H20O3 and molecular weight 260.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyclohexen-1-yl)-3-hydroxy-2-phenylbutanoic acid
Also Known As: 3-(cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid, 3-(cyclohexen-1-yl)-3-hydroxy-2-phenylbutanoic acid, 3-cyclohex-1-enyl-3-hydroxy-2-phenyl-butyric acid
| Molecular Formula | C16H20O3 |
|---|---|
| Molecular Weight | 260.14 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.14124 |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 6310-51-6 |
|---|---|
| SMILES | CC(C1=CCCCC1)(C(C2=CC=CC=C2)C(=O)O)O |
| InChIKey | GNCCBBXFPCKCJY-UHFFFAOYSA-N |
Product Overview
3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid (CAS 6310-51-6), with molecular formula C16H20O3 and molecular weight 260.14 g/mol. IUPAC: 3-(cyclohexen-1-yl)-3-hydroxy-2-phenylbutanoic acid.
Chemical Property Profile of 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid
Property Insights of 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid has 2 hydrogen bond donor(s) and 3 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-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid?
The CAS number of 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid is 6310-51-6.
What is the molecular formula of 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid?
The molecular formula of 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid is C16H20O3.
What is the molecular weight of 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid?
The molecular weight of 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid is 260.14 g/mol.
Where can I buy 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid?
You can request a quote for 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Cyclohex-1-en-1-yl)-3-hydroxy-2-phenylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.