2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid
TL;DR: 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid (CAS 1093651-93-4) is a chemical compound with molecular formula C14H17NO4 and molecular weight 263.11575 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-dihydroisoindole-1-carboxylic acid
Also Known As: 2-(tert-butoxycarbonyl)isoindoline-1-carboxylic acid, Boc-Disc-OH, Boc-DL-Disc-OH, Boc-(R,S)-1,3-dihydro-2H-isoindole carboxylic acid, 2-boc-isoindoline-1-carboxylic acid
Technical Specifications
| Molecular Formula | C14H17NO4 |
| Molecular Weight | 263.11575 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.11575 Da |
| Heavy Atoms | 19 |
| Complexity | 374.0 |
| SMILES | CC(C)(C)OC(=O)N1CC2=CC=CC=C2C1C(=O)O |
| InChIKey | BBMCBMREDOQCDU-UHFFFAOYSA-N |
Chemical Property Profile of 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid
Property Insights of 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid. Following Lipinski's Rule of Five, 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-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 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid?
The CAS number of 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid is 1093651-93-4.
What is the molecular formula of 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid?
The molecular formula of 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid is C14H17NO4.
What is the molecular weight of 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid?
The molecular weight of 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid is 263.11575 g/mol.
Where can I buy 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid?
You can request a quote for 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 2-((tert-butoxy)carbonyl)-2,3-dihydro-1H-isoindole-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.