Phenol, 4-chloro-2-(2-nitroethenyl)-
TL;DR: Phenol, 4-chloro-2-(2-nitroethenyl)- (CAS 61133-33-3) is a chemical compound with molecular formula C8H6ClNO3 and molecular weight 199.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-[(E)-2-nitroethenyl]phenol
Also Known As: Phenol, 4-chloro-2-(2-nitroethenyl)-, 4-chloro-2-(2-nitroethenyl)phenol, 4-Chloro-2-(2-nitrovinyl)phenol, 4-chloro-2-[(E)-2-nitroethenyl]phenol, (E)-4-chloro-2-(2-nitrovinyl)phenol
| Molecular Formula | C8H6ClNO3 |
|---|---|
| Molecular Weight | 199.00 g/mol |
| LogP | 2.293 |
| Topological Polar Surface Area | 63.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.00362 |
| Heavy Atoms | 13 |
| Complexity | 362.4068 |
Chemical Identifiers
| CAS Number | 61133-33-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)/C=C/[N+](=O)[O-])O |
Product Overview
Phenol, 4-chloro-2-(2-nitroethenyl)- (CAS 61133-33-3), with molecular formula C8H6ClNO3 and molecular weight 199.00 g/mol. IUPAC: 4-chloro-2-[(E)-2-nitroethenyl]phenol.
Chemical Property Profile of Phenol, 4-chloro-2-(2-nitroethenyl)-
Property Insights of Phenol, 4-chloro-2-(2-nitroethenyl)-
The XLogP value of 2.293 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 4-chloro-2-(2-nitroethenyl)-. The TPSA of 63.37 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 4-chloro-2-(2-nitroethenyl)-. Following Lipinski's Rule of Five, Phenol, 4-chloro-2-(2-nitroethenyl)- has 1 hydrogen bond donor(s) and 3 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 Phenol, 4-chloro-2-(2-nitroethenyl)-?
The CAS number of Phenol, 4-chloro-2-(2-nitroethenyl)- is 61133-33-3.
What is the molecular formula of Phenol, 4-chloro-2-(2-nitroethenyl)-?
The molecular formula of Phenol, 4-chloro-2-(2-nitroethenyl)- is C8H6ClNO3.
What is the molecular weight of Phenol, 4-chloro-2-(2-nitroethenyl)-?
The molecular weight of Phenol, 4-chloro-2-(2-nitroethenyl)- is 199.00 g/mol.
Where can I buy Phenol, 4-chloro-2-(2-nitroethenyl)-?
You can request a quote for Phenol, 4-chloro-2-(2-nitroethenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-chloro-2-(2-nitroethenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-chloro-2-(2-nitroethenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.