(R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid
TL;DR: (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid (CAS 905302-12-7) is a chemical compound with molecular formula C12H19F2NO4 and molecular weight 279.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-4,4-difluoro-3,3-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
Also Known As: (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid, J2.362.242D, Q-4558, (R)-1-(tert-Butoxycarbonyl)-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid, (2R)-4,4-difluoro-3,3-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
| Molecular Formula | C12H19F2NO4 |
|---|---|
| Molecular Weight | 279.13 g/mol |
| LogP | 2.3518 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.1282 |
| Heavy Atoms | 19 |
| Complexity | 401.0238 |
Chemical Identifiers
| CAS Number | 905302-12-7 |
|---|---|
| SMILES | CC1([C@@H](N(CC1(F)F)C(=O)OC(C)(C)C)C(=O)O)C |
Product Overview
(R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid (CAS 905302-12-7), with molecular formula C12H19F2NO4 and molecular weight 279.13 g/mol. IUPAC: (2R)-4,4-difluoro-3,3-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid
Property Insights of (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid
The XLogP value of 2.3518 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid. Following Lipinski's Rule of Five, (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid 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 (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid?
The CAS number of (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid is 905302-12-7.
What is the molecular formula of (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid?
The molecular formula of (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid is C12H19F2NO4.
What is the molecular weight of (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid?
The molecular weight of (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid is 279.13 g/mol.
Where can I buy (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid?
You can request a quote for (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (R)-1-Boc-4,4-difluoro-3,3-dimethylpyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.