(2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester
TL;DR: (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester (CAS 120226-40-6) is a chemical compound with molecular formula C14H19NO3 and molecular weight 249.13649 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(2,2-dimethylpropanoylamino)-2-phenylacetate
Also Known As: Methyl 2-phenyl-2-pivalamidoacetate, N-Pivaloyl-DL-phenylglycin-methylester, methyl 2-(2,2-dimethylpropanamido)-2-phenylacetate, (2,2-dimethyl-propionylamino)-phenyl-acetic acid methyl ester, methyl [(2,2-dimethylpropanoyl)amino](phenyl)acetate
Technical Specifications
| Molecular Formula | C14H19NO3 |
| Molecular Weight | 249.13649 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.13649 Da |
| Heavy Atoms | 18 |
| Complexity | 301.0 |
| SMILES | CC(C)(C)C(=O)NC(C1=CC=CC=C1)C(=O)OC |
| InChIKey | VEFCLBBOUMFNEI-UHFFFAOYSA-N |
Chemical Property Profile of (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester
Property Insights of (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester has 1 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 (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester?
The CAS number of (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester is 120226-40-6.
What is the molecular formula of (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester?
The molecular formula of (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester is C14H19NO3.
What is the molecular weight of (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester?
The molecular weight of (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester is 249.13649 g/mol.
Where can I buy (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester?
You can request a quote for (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester?
Yes, CoreyChem provides custom synthesis services for (2,2-Dimethyl-propionylamino)-phenyl-acetic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.