Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride
TL;DR: Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride (CAS 63906-44-5) is a chemical compound with molecular formula C12H18ClNO3 and molecular weight 259.09753 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[2-(2-phenoxyacetyl)oxyethyl]azanium chloride
Also Known As: Phenoxyacetic acid 2-(dimethylamino)ethyl ester hydrochloride, ACETIC ACID, PHENOXY-, 2-DIMETHYLAMINOETHYL ESTER, HYDROCHLORIDE, dimethyl-[2-(2-phenoxyacetyl)oxyethyl]azanium chloride, Acetic acid, phenoxy-, 2-(dimethylamino)ethyl ester, hydrochloride
Technical Specifications
| Molecular Formula | C12H18ClNO3 |
| Molecular Weight | 259.09753 g/mol |
| XLogP | -3.24 |
| Topological Polar Surface Area (TPSA) | 40.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 259.09753 Da |
| Heavy Atoms | 17 |
| Complexity | 200.0 |
| SMILES | C[NH+](C)CCOC(=O)COC1=CC=CC=C1.[Cl-] |
| InChIKey | PFQDPIRIPKGLJL-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride
Property Insights of Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride
The XLogP value of -3.24 indicates that Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.0 Ų, Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride has 1 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 Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride?
The CAS number of Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride is 63906-44-5.
What is the molecular formula of Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride?
The molecular formula of Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride is C12H18ClNO3.
What is the molecular weight of Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride?
The molecular weight of Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride is 259.09753 g/mol.
Where can I buy Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride?
You can request a quote for Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Acetic acid, phenoxy-, 2-dimethylaminoethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.