Boc-3-Nitro-D-phenylalanine
TL;DR: Boc-3-Nitro-D-phenylalanine (CAS 501015-24-3) is a chemical compound with molecular formula C14H18N2O6 and molecular weight 310.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-nitrophenyl)propanoic acid
Also Known As: Boc-3-Nitro-D-phenylalanine, Boc-D-3-Nitrophe, Boc-L-3-Nitrophe, BOC-D-3-NITROPHENYLALANINE, (R)-2-((tert-Butoxycarbonyl)amino)-3-(3-nitrophenyl)propanoic acid
| Molecular Formula | C14H18N2O6 |
|---|---|
| Molecular Weight | 310.12 g/mol |
| LogP | 2.1152 |
| Topological Polar Surface Area | 118.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.1165 |
| Heavy Atoms | 22 |
| Complexity | 578.941 |
Chemical Identifiers
| CAS Number | 501015-24-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@H](CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)O |
Product Overview
Boc-3-Nitro-D-phenylalanine (CAS 501015-24-3), with molecular formula C14H18N2O6 and molecular weight 310.12 g/mol. IUPAC: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(3-nitrophenyl)propanoic acid.
Chemical Property Profile of Boc-3-Nitro-D-phenylalanine
Property Insights of Boc-3-Nitro-D-phenylalanine
The XLogP value of 2.1152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-3-Nitro-D-phenylalanine. The TPSA of 118.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-3-Nitro-D-phenylalanine. Following Lipinski's Rule of Five, Boc-3-Nitro-D-phenylalanine has 2 hydrogen bond donor(s) and 5 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 Boc-3-Nitro-D-phenylalanine?
The CAS number of Boc-3-Nitro-D-phenylalanine is 501015-24-3.
What is the molecular formula of Boc-3-Nitro-D-phenylalanine?
The molecular formula of Boc-3-Nitro-D-phenylalanine is C14H18N2O6.
What is the molecular weight of Boc-3-Nitro-D-phenylalanine?
The molecular weight of Boc-3-Nitro-D-phenylalanine is 310.12 g/mol.
Where can I buy Boc-3-Nitro-D-phenylalanine?
You can request a quote for Boc-3-Nitro-D-phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-3-Nitro-D-phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for Boc-3-Nitro-D-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.