1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-
TL;DR: 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)- (CAS 77977-75-4) is a chemical compound with molecular formula C8H9NO4 and molecular weight 183.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-1-(4-nitrophenyl)ethane-1,2-diol
Also Known As: 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-, (1S)-1-(4-nitrophenyl)ethane-1,2-diol, 1-(4-nitrophenyl)ethane-1,2-diol, (S)-1-(4-Nitrophenyl)-1,2-ethanediol, (S)-1-(4-Nitrophenyl)ethane-1,2-diol
| Molecular Formula | C8H9NO4 |
|---|---|
| Molecular Weight | 183.05 g/mol |
| LogP | 0.6205 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 183.05316 |
| Heavy Atoms | 13 |
| Complexity | 295.51727 |
Chemical Identifiers
| CAS Number | 77977-75-4 |
|---|---|
| SMILES | C1=CC(=CC=C1[C@@H](CO)O)[N+](=O)[O-] |
Product Overview
1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)- (CAS 77977-75-4), with molecular formula C8H9NO4 and molecular weight 183.05 g/mol. IUPAC: (1S)-1-(4-nitrophenyl)ethane-1,2-diol.
Chemical Property Profile of 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-
Property Insights of 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-
The XLogP value of 0.6205 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-. Following Lipinski's Rule of Five, 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)- 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
Frequently Asked Questions
What is the CAS number of 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-?
The CAS number of 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)- is 77977-75-4.
What is the molecular formula of 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-?
The molecular formula of 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)- is C8H9NO4.
What is the molecular weight of 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-?
The molecular weight of 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)- is 183.05 g/mol.
Where can I buy 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-?
You can request a quote for 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Ethanediol, 1-(4-nitrophenyl)-, (1S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.