Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester
TL;DR: Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester (CAS 85209-63-8) is a chemical compound with molecular formula C16H19NO2 and molecular weight 257.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]acetate
Also Known As: ASISCHEM Z06232, ethyl 2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]acetate, 4-(2,5-Dimetil-1-pirril)fenilacetao di etile, Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester, 4-(2,5-Dimetil-1-pirril)fenilacetao di etile [Italian]
| Molecular Formula | C16H19NO2 |
|---|---|
| Molecular Weight | 257.14 g/mol |
| LogP | 3.19974 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.14157 |
| Heavy Atoms | 19 |
| Complexity | 547.43494 |
Chemical Identifiers
| CAS Number | 85209-63-8 |
|---|---|
| SMILES | CCOC(=O)CC1=CC=C(C=C1)N2C(=CC=C2C)C |
Product Overview
Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester (CAS 85209-63-8), with molecular formula C16H19NO2 and molecular weight 257.14 g/mol. IUPAC: ethyl 2-[4-(2,5-dimethylpyrrol-1-yl)phenyl]acetate.
Chemical Property Profile of Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester
Property Insights of Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester
The XLogP value of 3.19974 indicates that Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.23 Ų, Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester 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 Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester?
The CAS number of Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester is 85209-63-8.
What is the molecular formula of Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester?
The molecular formula of Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester is C16H19NO2.
What is the molecular weight of Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester?
The molecular weight of Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester is 257.14 g/mol.
Where can I buy Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester?
You can request a quote for Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (p-(2,5-dimethyl-1-pyrrolyl)phenyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.