Boc-3-Nitro-L-Phenylalanine
TL;DR: Boc-3-Nitro-L-Phenylalanine (CAS 158741-21-0) is a chemical compound with molecular formula C14H18N2O6 and molecular weight 310.1165 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-nitrophenyl)propanoic acid
Also Known As: Boc-3-Nitro-L-Phenylalanine, Boc-L-3-Nitrophenylalanine, Boc-L-3-Nitrophe, Boc-Phe(3-NO2)-OH, Boc-3-nitro-L-Phe-OH
Technical Specifications
| Molecular Formula | C14H18N2O6 |
| Molecular Weight | 310.1165 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 310.1165 Da |
| Heavy Atoms | 22 |
| Complexity | 426.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)O |
| InChIKey | OWTGPXDXLMNQKK-NSHDSACASA-N |
Chemical Property Profile of Boc-3-Nitro-L-Phenylalanine
Property Insights of Boc-3-Nitro-L-Phenylalanine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-3-Nitro-L-Phenylalanine. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-3-Nitro-L-Phenylalanine. Following Lipinski's Rule of Five, Boc-3-Nitro-L-Phenylalanine has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Boc-3-Nitro-L-Phenylalanine?
The CAS number of Boc-3-Nitro-L-Phenylalanine is 158741-21-0.
What is the molecular formula of Boc-3-Nitro-L-Phenylalanine?
The molecular formula of Boc-3-Nitro-L-Phenylalanine is C14H18N2O6.
What is the molecular weight of Boc-3-Nitro-L-Phenylalanine?
The molecular weight of Boc-3-Nitro-L-Phenylalanine is 310.1165 g/mol.
Where can I buy Boc-3-Nitro-L-Phenylalanine?
You can request a quote for Boc-3-Nitro-L-Phenylalanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Boc-3-Nitro-L-Phenylalanine?
Yes, CoreyChem provides custom synthesis services for Boc-3-Nitro-L-Phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.