Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester
TL;DR: Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester (CAS 112474-02-9) is a chemical compound with molecular formula C21H24O4 and molecular weight 340.16745 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-phenoxyphenyl)methyl 3-methyl-2-prop-2-enoxybutanoate
Also Known As: Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester, (3-phenoxyphenyl)methyl 3-methyl-2-prop-2-enoxy-butanoate, (3-phenoxyphenyl)methyl 3-methyl-2-prop-2-enoxybutanoate, (3-Phenoxyphenyl)methyl 3-methyl-2-[(prop-2-en-1-yl)oxy]butanoate
Technical Specifications
| Molecular Formula | C21H24O4 |
| Molecular Weight | 340.16745 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 340.16745 Da |
| Heavy Atoms | 25 |
| Complexity | 401.0 |
| SMILES | CC(C)C(C(=O)OCC1=CC(=CC=C1)OC2=CC=CC=C2)OCC=C |
| InChIKey | FBPXKSJIHQFJLE-UHFFFAOYSA-N |
Chemical Property Profile of Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester
Property Insights of Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester
The XLogP value of 5.0 indicates that Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl 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
What is the CAS number of Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester?
The CAS number of Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester is 112474-02-9.
What is the molecular formula of Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester?
The molecular formula of Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester is C21H24O4.
What is the molecular weight of Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester?
The molecular weight of Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester is 340.16745 g/mol.
Where can I buy Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester?
You can request a quote for Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester?
Yes, CoreyChem provides custom synthesis services for Butanoic acid, 3-methyl-2-(2-propenyloxy)-, (3-phenoxyphenyl)methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.