Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester
TL;DR: Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester (CAS 144193-96-4) is a chemical compound with molecular formula C8H14Cl2O2 and molecular weight 212.03708 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4,4-dichloro-2,2-dimethylbutanoate
Also Known As: ethyl 4,4-dichloro-2,2-dimethylbutanoate, Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester, Ethyl 4,4-dichloro-2,2-dimethyl-butanoate, 4,4-Dichloro-2,2-dimethylbutanoic acid ethyl ester
Technical Specifications
| Molecular Formula | C8H14Cl2O2 |
| Molecular Weight | 212.03708 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 212.03708 Da |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
| SMILES | CCOC(=O)C(C)(C)CC(Cl)Cl |
| InChIKey | BVWOGJBGZCUYRJ-UHFFFAOYSA-N |
Chemical Property Profile of Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester
Property Insights of Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester
The XLogP value of 3.0 indicates that Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanoic acid, 4,4-dichloro-2,2-dimethyl-, 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
What is the CAS number of Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester?
The CAS number of Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester is 144193-96-4.
What is the molecular formula of Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester?
The molecular formula of Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester is C8H14Cl2O2.
What is the molecular weight of Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester?
The molecular weight of Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester is 212.03708 g/mol.
Where can I buy Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester?
You can request a quote for Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Butanoic acid, 4,4-dichloro-2,2-dimethyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.