Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester
TL;DR: Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester (CAS 42019-16-9) is a chemical compound with molecular formula C18H26O4 and molecular weight 306.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-methyl-2-(4-pentanoylphenoxy)propanoate
Also Known As: Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester, 1-Methylethyl 2-methyl-2-(4-(1-oxopentyl)phenoxy)propanoate, propan-2-yl 2-methyl-2-(4-pentanoylphenoxy)propanoate, 2-Methyl-2-(4-(1-oxopentyl)phenoxy)propanoic acid 1-methylethyl ester, BRN 1996383
| Molecular Formula | C18H26O4 |
|---|---|
| Molecular Weight | 306.18 g/mol |
| LogP | 4.1685 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 306.1831 |
| Heavy Atoms | 22 |
| Complexity | 500.32336 |
Chemical Identifiers
| CAS Number | 42019-16-9 |
|---|---|
| SMILES | CCCCC(=O)C1=CC=C(C=C1)OC(C)(C)C(=O)OC(C)C |
Product Overview
Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester (CAS 42019-16-9), with molecular formula C18H26O4 and molecular weight 306.18 g/mol. IUPAC: propan-2-yl 2-methyl-2-(4-pentanoylphenoxy)propanoate.
Chemical Property Profile of Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester
Property Insights of Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester
The XLogP value of 4.1685 indicates that Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester has 0 hydrogen bond donor(s) and 4 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 Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester?
The CAS number of Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester is 42019-16-9.
What is the molecular formula of Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester?
The molecular formula of Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester is C18H26O4.
What is the molecular weight of Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester?
The molecular weight of Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester is 306.18 g/mol.
Where can I buy Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester?
You can request a quote for Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 2-methyl-2-(4-(1-oxopentyl)phenoxy)-, 1-methylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.