Acetic acid, chloro-, 1-methoxyisopropyl ester
TL;DR: Acetic acid, chloro-, 1-methoxyisopropyl ester (CAS 64046-46-4) is a chemical compound with molecular formula C6H11ClO3 and molecular weight 166.03967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxypropan-2-yl 2-chloroacetate
Also Known As: 1-Methoxyisopropyl chloroacetate, 2-methoxypropan-2-yl 2-chloroacetate, 2-Methoxypropan-2-yl chloroacetate, ACETIC ACID, CHLORO-, 1-METHOXYISOPROPYL ESTER, Chloroacetic acid 1-methoxy-1-methylethyl ester
Technical Specifications
| Molecular Formula | C6H11ClO3 |
| Molecular Weight | 166.03967 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 166.03967 Da |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
| SMILES | CC(C)(OC)OC(=O)CCl |
| InChIKey | PFYYFYKWCJMOMO-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, chloro-, 1-methoxyisopropyl ester
Property Insights of Acetic acid, chloro-, 1-methoxyisopropyl ester
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, chloro-, 1-methoxyisopropyl ester. With a topological polar surface area (TPSA) of 35.5 Ų, Acetic acid, chloro-, 1-methoxyisopropyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, chloro-, 1-methoxyisopropyl ester 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
What is the CAS number of Acetic acid, chloro-, 1-methoxyisopropyl ester?
The CAS number of Acetic acid, chloro-, 1-methoxyisopropyl ester is 64046-46-4.
What is the molecular formula of Acetic acid, chloro-, 1-methoxyisopropyl ester?
The molecular formula of Acetic acid, chloro-, 1-methoxyisopropyl ester is C6H11ClO3.
What is the molecular weight of Acetic acid, chloro-, 1-methoxyisopropyl ester?
The molecular weight of Acetic acid, chloro-, 1-methoxyisopropyl ester is 166.03967 g/mol.
Where can I buy Acetic acid, chloro-, 1-methoxyisopropyl ester?
You can request a quote for Acetic acid, chloro-, 1-methoxyisopropyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, chloro-, 1-methoxyisopropyl ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid, chloro-, 1-methoxyisopropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.