Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate
TL;DR: Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate (CAS 133748-30-8) is a chemical compound with molecular formula C12H13NO4 and molecular weight 235.08446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate
Also Known As: methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate, Methyl 1-(4-hydroxyphenyl)-5-oxo-3-pyrrolidinecarboxylate, BAS 00829326, BIM-0003990.P001, 3-Pyrrolidinecarboxylic acid, 1-(4-hydroxyphenyl)-5-oxo-, methyl ester
Technical Specifications
| Molecular Formula | C12H13NO4 |
| Molecular Weight | 235.08446 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.08446 Da |
| Heavy Atoms | 17 |
| Complexity | 310.0 |
| SMILES | COC(=O)C1CC(=O)N(C1)C2=CC=C(C=C2)O |
| InChIKey | LNCZWDCYTJRWGX-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate
Property Insights of Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate. Following Lipinski's Rule of Five, Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate 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 Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate?
The CAS number of Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate is 133748-30-8.
What is the molecular formula of Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate?
The molecular formula of Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate is C12H13NO4.
What is the molecular weight of Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate?
The molecular weight of Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate is 235.08446 g/mol.
Where can I buy Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate?
You can request a quote for Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 1-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.