环戊基3,4-二羟基苯基酮
TL;DR: 环戊基3,4-二羟基苯基酮 (CAS 67239-27-4) is a chemical compound with molecular formula C12H14O3 and molecular weight 206.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环戊基3,4-二羟基苯基酮
cyclopentyl-(3,4-dihydroxyphenyl)methanone
Also Known As: Cyclopentyl 3,4-dihydroxyphenyl ketone, KETONE, CYCLOPENTYL 3,4-DIHYDROXYPHENYL, cyclopentyl-(3,4-dihydroxyphenyl)methanone, Cyclopentyl(3,4-dihydroxyphenyl) ketone, cyclopentyl(3,4-dihydroxyphenyl)methanone
| Molecular Formula | C12H14O3 |
|---|---|
| Molecular Weight | 206.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.0943 |
| Heavy Atoms | 15 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 67239-27-4 |
|---|---|
| SMILES | C1CCC(C1)C(=O)C2=CC(=C(C=C2)O)O |
| InChIKey | ICPUNZJSJWFCOT-UHFFFAOYSA-N |
Product Overview
环戊基3,4-二羟基苯基酮 (CAS 67239-27-4), with molecular formula C12H14O3 and molecular weight 206.09 g/mol. IUPAC: cyclopentyl-(3,4-dihydroxyphenyl)methanone.
Chemical Property Profile of 环戊基3,4-二羟基苯基酮
Property Insights of 环戊基3,4-二羟基苯基酮
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 环戊基3,4-二羟基苯基酮. With a topological polar surface area (TPSA) of 57.5 Ų, 环戊基3,4-二羟基苯基酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环戊基3,4-二羟基苯基酮 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 环戊基3,4-二羟基苯基酮?
The CAS number of 环戊基3,4-二羟基苯基酮 is 67239-27-4.
What is the molecular formula of 环戊基3,4-二羟基苯基酮?
The molecular formula of 环戊基3,4-二羟基苯基酮 is C12H14O3.
What is the molecular weight of 环戊基3,4-二羟基苯基酮?
The molecular weight of 环戊基3,4-二羟基苯基酮 is 206.09 g/mol.
Where can I buy 环戊基3,4-二羟基苯基酮?
You can request a quote for 环戊基3,4-二羟基苯基酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环戊基3,4-二羟基苯基酮?
Yes, KEHONG BIO provides custom synthesis services for 环戊基3,4-二羟基苯基酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.