Benzene, pentachloro(2-nitroethenyl)-
TL;DR: Benzene, pentachloro(2-nitroethenyl)- (CAS 18840-56-7) is a chemical compound with molecular formula C8H2Cl5NO2 and molecular weight 318.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5-pentachloro-6-[(E)-2-nitroethenyl]benzene
Also Known As: Benzene, pentachloro(2-nitroethenyl)-, 2,3,4,5,6-Pentachloro-beta-nitrostyrene, Styrene, 2,3,4,5,6-pentachloro-beta-nitro-, 1,2,3,4,5-pentachloro-6-[(E)-2-nitroethenyl]benzene
| Molecular Formula | C8H2Cl5NO2 |
|---|---|
| Molecular Weight | 318.85 g/mol |
| LogP | 5.201 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.8528 |
| Heavy Atoms | 16 |
| Complexity | 456.8024 |
Chemical Identifiers
| CAS Number | 18840-56-7 |
|---|---|
| SMILES | C(=C/[N+](=O)[O-])\C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
Product Overview
Benzene, pentachloro(2-nitroethenyl)- (CAS 18840-56-7), with molecular formula C8H2Cl5NO2 and molecular weight 318.85 g/mol. IUPAC: 1,2,3,4,5-pentachloro-6-[(E)-2-nitroethenyl]benzene.
Chemical Property Profile of Benzene, pentachloro(2-nitroethenyl)-
Property Insights of Benzene, pentachloro(2-nitroethenyl)-
The XLogP value of 5.201 indicates that Benzene, pentachloro(2-nitroethenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.14 Ų, Benzene, pentachloro(2-nitroethenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, pentachloro(2-nitroethenyl)- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, pentachloro(2-nitroethenyl)-?
The CAS number of Benzene, pentachloro(2-nitroethenyl)- is 18840-56-7.
What is the molecular formula of Benzene, pentachloro(2-nitroethenyl)-?
The molecular formula of Benzene, pentachloro(2-nitroethenyl)- is C8H2Cl5NO2.
What is the molecular weight of Benzene, pentachloro(2-nitroethenyl)-?
The molecular weight of Benzene, pentachloro(2-nitroethenyl)- is 318.85 g/mol.
Where can I buy Benzene, pentachloro(2-nitroethenyl)-?
You can request a quote for Benzene, pentachloro(2-nitroethenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, pentachloro(2-nitroethenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, pentachloro(2-nitroethenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.