2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-
TL;DR: 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- (CAS 89765-17-3) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-ethoxyphenyl)-3-methylbutan-2-one
Also Known As: 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-, 3-(4-ethoxyphenyl)-3-methylbutan-2-one, 2-(4-ethoxyphenyl)-2-methyl-3-butanone, 3-(4-Ethoxyphenyl)-3-methyl-2-butanone, 3-[4-Ethoxyphenyl]-3-methyl-2-butanone
| Molecular Formula | C13H18O2 |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 2.9519 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.13068 |
| Heavy Atoms | 15 |
| Complexity | 336.0585 |
Chemical Identifiers
| CAS Number | 89765-17-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(C)(C)C(=O)C |
Product Overview
2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- (CAS 89765-17-3), with molecular formula C13H18O2 and molecular weight 206.13 g/mol. IUPAC: 3-(4-ethoxyphenyl)-3-methylbutan-2-one.
Chemical Property Profile of 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-
Property Insights of 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-
The XLogP value of 2.9519 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- has 0 hydrogen bond donor(s) and 2 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 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-?
The CAS number of 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- is 89765-17-3.
What is the molecular formula of 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-?
The molecular formula of 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- is C13H18O2.
What is the molecular weight of 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-?
The molecular weight of 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- is 206.13 g/mol.
Where can I buy 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-?
You can request a quote for 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butanone, 3-(4-ethoxyphenyl)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.