![3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid structure](/static/products/1241/1241681-36-6.webp)
3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid
TL;DR: 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid (CAS 1241681-36-6) is a chemical compound with molecular formula C14H17Cl2NO4 and molecular weight 333.05347 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,4-dichlorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: 3-[(tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid, RARECHEM AK HT T316, 3-((tert-Butoxycarbonyl)amino)-3-(3,4-dichlorophenyl)propanoic acid, AA165, 3-tert-butoxycarbonylamino-3-(3,4-dichloro-phenyl)-propionic acid
Technical Specifications
| Molecular Formula | C14H17Cl2NO4 |
| Molecular Weight | 333.05347 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.05347 Da |
| Heavy Atoms | 21 |
| Complexity | 384.0 |
| SMILES | CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=C(C=C1)Cl)Cl |
| InChIKey | WERAVAVZZMWCOE-UHFFFAOYSA-N |
Chemical Property Profile of 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid
Property Insights of 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid
The XLogP value of 3.2 indicates that 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid. Following Lipinski's Rule of Five, 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid has 2 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 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid?
The CAS number of 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid is 1241681-36-6.
What is the molecular formula of 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid?
The molecular formula of 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid is C14H17Cl2NO4.
What is the molecular weight of 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid?
The molecular weight of 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid is 333.05347 g/mol.
Where can I buy 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid?
You can request a quote for 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid?
Yes, CoreyChem provides custom synthesis services for 3-[(Tert-butoxycarbonyl)amino]-3-(3,4-dichlorophenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.