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1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid
TL;DR: 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid (CAS 1426559-87-6) is a chemical compound with molecular formula C16H21NO4 and molecular weight 291.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2-methylpropan-2-yl)oxycarbonyl]-3-phenylpyrrolidine-2-carboxylic acid
Also Known As: 1-(TERT-BUTOXYCARBONYL)-3-PHENYLPYRROLIDINE-2-CARBOXYLIC ACID, 3-PHENYL-PYRROLIDINE-1,2-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER, Boc-cis-DL-3-phenyl-Pro-OH, 2389AJ, 1-(TERT-BUTOXYCARBONYL)-3-PHENYLPROLINE
Technical Specifications
| Molecular Formula | C16H21NO4 |
| Molecular Weight | 291.14706 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.14706 Da |
| Heavy Atoms | 21 |
| Complexity | 396.0 |
| SMILES | CC(C)(C)OC(=O)N1CCC(C1C(=O)O)C2=CC=CC=C2 |
| InChIKey | LNVFMMJOXRYVKX-UHFFFAOYSA-N |
Chemical Property Profile of 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid
Property Insights of 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid 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 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid?
The CAS number of 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid is 1426559-87-6.
What is the molecular formula of 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid?
The molecular formula of 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid is C16H21NO4.
What is the molecular weight of 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid?
The molecular weight of 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid is 291.14706 g/mol.
Where can I buy 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid?
You can request a quote for 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-[(Tert-butoxy)carbonyl]-3-phenylpyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.