3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-
TL;DR: 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- (CAS 3411-09-4) is a chemical compound with molecular formula C17H24O3 and molecular weight 276.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-(2,6-dimethoxy-4-pentylphenyl)but-3-en-2-one
Also Known As: 4- -3-buten-2-one, 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-, 4-(2,6-Dimethoxy-4-pentylphenyl)-3-buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)but-3-en-2-one, (E)-4-(2,6-dimethoxy-4-pentylphenyl)but-3-en-2-one
| Molecular Formula | C17H24O3 |
|---|---|
| Molecular Weight | 276.17 g/mol |
| LogP | 4.0387 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 276.17255 |
| Heavy Atoms | 20 |
| Complexity | 450.11862 |
Chemical Identifiers
| CAS Number | 3411-09-4 |
|---|---|
| SMILES | CCCCCC1=CC(=C(C(=C1)OC)/C=C/C(=O)C)OC |
Product Overview
3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- (CAS 3411-09-4), with molecular formula C17H24O3 and molecular weight 276.17 g/mol. IUPAC: (E)-4-(2,6-dimethoxy-4-pentylphenyl)but-3-en-2-one.
Chemical Property Profile of 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-
Property Insights of 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-
The XLogP value of 4.0387 indicates that 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- has 0 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-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-?
The CAS number of 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- is 3411-09-4.
What is the molecular formula of 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-?
The molecular formula of 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- is C17H24O3.
What is the molecular weight of 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-?
The molecular weight of 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- is 276.17 g/mol.
Where can I buy 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-?
You can request a quote for 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Buten-2-one, 4-(2,6-dimethoxy-4-pentylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.