1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene
TL;DR: 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene (CAS 62180-90-9) is a chemical compound with molecular formula C12Cl11NO2 and molecular weight 574.65 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5,6-hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene
Also Known As: PCNB-HEXACHLOROBENZENE (MIXT.), 1,2,3,4,5,6-hexachlorobenzene; 1,2,3,4,5-pentachloro-6-nitrobenzene
| Molecular Formula | C12Cl11NO2 |
|---|---|
| Molecular Weight | 574.65 g/mol |
| LogP | 10.47 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 578.6444 |
| Heavy Atoms | 26 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 62180-90-9 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[N+](=O)[O-].C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | DMVYFLWWJIGQSM-UHFFFAOYSA-N |
Product Overview
1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene (CAS 62180-90-9), with molecular formula C12Cl11NO2 and molecular weight 574.65 g/mol. IUPAC: 1,2,3,4,5,6-hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene.
Chemical Property Profile of 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene
Property Insights of 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene
The XLogP value of 10.47 indicates that 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene 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 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene?
The CAS number of 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene is 62180-90-9.
What is the molecular formula of 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene?
The molecular formula of 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene is C12Cl11NO2.
What is the molecular weight of 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene?
The molecular weight of 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene is 574.65 g/mol.
Where can I buy 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene?
You can request a quote for 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4,5,6-Hexachlorobenzene;1,2,3,4,5-pentachloro-6-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.