trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid
TL;DR: trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid (CAS 1414958-09-0) is a chemical compound with molecular formula C12H21NO4 and molecular weight 243.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S,4R)-3-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
Also Known As: starbld0042575, (3S,4R)-1-[(tert-butoxy)carbonyl]-3-methylpiperidine-4-carboxylic acid, trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid, trans-1-N-Boc-3-methylpiperidine-4-carboxylic acid, (3S,4R)-1-(tert-Butoxycarbonyl)-3-methylpiperidine-4-carboxylic acid
Technical Specifications
| Molecular Formula | C12H21NO4 |
| Molecular Weight | 243.14706 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.14706 Da |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
| SMILES | C[C@@H]1CN(CC[C@H]1C(=O)O)C(=O)OC(C)(C)C |
| InChIKey | ZFQQTPBWJCJGSV-RKDXNWHRSA-N |
Chemical Property Profile of trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid
Property Insights of trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid. Following Lipinski's Rule of Five, trans-1-N-Boc-3-methyl-piperidine-4-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 trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid?
The CAS number of trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid is 1414958-09-0.
What is the molecular formula of trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid?
The molecular formula of trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid is C12H21NO4.
What is the molecular weight of trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid?
The molecular weight of trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid is 243.14706 g/mol.
Where can I buy trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid?
You can request a quote for trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for trans-1-N-Boc-3-methyl-piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.