(2-Amino-2-oxoethyl) 4-methylbenzoate
TL;DR: (2-Amino-2-oxoethyl) 4-methylbenzoate (CAS 64649-46-3) is a chemical compound with molecular formula C10H11NO3 and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-amino-2-oxoethyl) 4-methylbenzoate
Also Known As: Carbamoylmethyl 4-methylbenzoate, 2-amino-2-oxoethyl 4-methylbenzoate, (2-amino-2-oxoethyl) 4-methylbenzoate
| Molecular Formula | C10H11NO3 |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 0.63712 |
| Topological Polar Surface Area | 69.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.0739 |
| Heavy Atoms | 14 |
| Complexity | 342.88968 |
Chemical Identifiers
| CAS Number | 64649-46-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OCC(=O)N |
Product Overview
(2-Amino-2-oxoethyl) 4-methylbenzoate (CAS 64649-46-3), with molecular formula C10H11NO3 and molecular weight 193.07 g/mol. IUPAC: (2-amino-2-oxoethyl) 4-methylbenzoate.
Chemical Property Profile of (2-Amino-2-oxoethyl) 4-methylbenzoate
Property Insights of (2-Amino-2-oxoethyl) 4-methylbenzoate
The XLogP value of 0.63712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Amino-2-oxoethyl) 4-methylbenzoate. The TPSA of 69.39 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Amino-2-oxoethyl) 4-methylbenzoate. Following Lipinski's Rule of Five, (2-Amino-2-oxoethyl) 4-methylbenzoate 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
Frequently Asked Questions
What is the CAS number of (2-Amino-2-oxoethyl) 4-methylbenzoate?
The CAS number of (2-Amino-2-oxoethyl) 4-methylbenzoate is 64649-46-3.
What is the molecular formula of (2-Amino-2-oxoethyl) 4-methylbenzoate?
The molecular formula of (2-Amino-2-oxoethyl) 4-methylbenzoate is C10H11NO3.
What is the molecular weight of (2-Amino-2-oxoethyl) 4-methylbenzoate?
The molecular weight of (2-Amino-2-oxoethyl) 4-methylbenzoate is 193.07 g/mol.
Where can I buy (2-Amino-2-oxoethyl) 4-methylbenzoate?
You can request a quote for (2-Amino-2-oxoethyl) 4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Amino-2-oxoethyl) 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Amino-2-oxoethyl) 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.