1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one
TL;DR: 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one (CAS 79558-49-9) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dihydroxy-3-propylphenyl)propan-1-one
Also Known As: 1-(2,4-dihydroxy-3-propylphenyl)propan-1-one, 1-Propanone, 1-(2,4-dihydroxy-3-propylphenyl)-, 1-(2,4-dihydroxy-3-propylphenyl)-1-propanone
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 2.643 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 369.37512 |
Chemical Identifiers
| CAS Number | 79558-49-9 |
|---|---|
| SMILES | CCCC1=C(C=CC(=C1O)C(=O)CC)O |
Product Overview
1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one (CAS 79558-49-9), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: 1-(2,4-dihydroxy-3-propylphenyl)propan-1-one.
Chemical Property Profile of 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one
Property Insights of 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one
The XLogP value of 2.643 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one. With a topological polar surface area (TPSA) of 57.53 Ų, 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one 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 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one?
The CAS number of 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one is 79558-49-9.
What is the molecular formula of 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one?
The molecular formula of 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one is C12H16O3.
What is the molecular weight of 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one?
The molecular weight of 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one is 208.11 g/mol.
Where can I buy 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one?
You can request a quote for 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dihydroxy-3-propylphenyl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.