Alanine p-nitrophenyl ester
TL;DR: Alanine p-nitrophenyl ester (CAS 58848-62-7) is a chemical compound with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) (2S)-2-aminopropanoate
Also Known As: alanine p-nitrophenyl ester, L-Alanine 4-nitrophenyl ester, Boc-L-alanine-p-nitrophenyl ester, 4-nitrophenyl (2S)-2-aminopropanoate, (4-nitrophenyl) (2S)-2-aminopropanoate
| Molecular Formula | C9H10N2O4 |
|---|---|
| Molecular Weight | 210.06 g/mol |
| LogP | 0.8474 |
| Topological Polar Surface Area | 95.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.06406 |
| Heavy Atoms | 15 |
| Complexity | 372.20367 |
Chemical Identifiers
| CAS Number | 58848-62-7 |
|---|---|
| SMILES | C[C@@H](C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])N |
Product Overview
Alanine p-nitrophenyl ester (CAS 58848-62-7), with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol. IUPAC: (4-nitrophenyl) (2S)-2-aminopropanoate.
Chemical Property Profile of Alanine p-nitrophenyl ester
Property Insights of Alanine p-nitrophenyl ester
The XLogP value of 0.8474 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Alanine p-nitrophenyl ester. The TPSA of 95.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine p-nitrophenyl ester. Following Lipinski's Rule of Five, Alanine p-nitrophenyl ester has 1 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 Alanine p-nitrophenyl ester?
The CAS number of Alanine p-nitrophenyl ester is 58848-62-7.
What is the molecular formula of Alanine p-nitrophenyl ester?
The molecular formula of Alanine p-nitrophenyl ester is C9H10N2O4.
What is the molecular weight of Alanine p-nitrophenyl ester?
The molecular weight of Alanine p-nitrophenyl ester is 210.06 g/mol.
Where can I buy Alanine p-nitrophenyl ester?
You can request a quote for Alanine p-nitrophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alanine p-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Alanine p-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.