RefChem:71240
TL;DR: RefChem:71240 (CAS 84195-76-6) is a chemical compound with molecular formula C20H5Cl14NO2 and molecular weight 780.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5,6,7,10,11,16,17,18,19,19,20,20-tetradecachloro-12-nitrohexacyclo[14.2.1.14,7.02,15.03,8.09,14]icosa-5,9,11,13,17-pentaene
Also Known As: EINECS 282-383-6, 1,2,3,4,5,6,7,8,9,10,13,13,14,14-Tetradecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-11-nitro-1,4:5,8-dimethanotriphenylene, 1,2,3,4,5,6,7,8,9,10,13,13,14,14-Tetradecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene, 1,2-Dichloro-3-nitronaphthalene-bis(hexachlorocyclopentadiene) adduct, 1,4,5,6,7,10,11,16,17,18,19,19,20,20-tetradecachloro-12-nitrohexacyclo[14.2.1.14,7.02,15.03,8.09,14]icosa-5,9(14),10,12,17-pentaene
| Molecular Formula | C20H5Cl14NO2 |
|---|---|
| Molecular Weight | 780.60 g/mol |
| LogP | 11.0058 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 780.59595 |
| Heavy Atoms | 37 |
| Complexity | 1440.2063 |
Chemical Identifiers
| CAS Number | 84195-76-6 |
|---|---|
| SMILES | C1=C2C3C(C4C(C2=C(C(=C1[N+](=O)[O-])Cl)Cl)C5(C(=C(C4(C5(Cl)Cl)Cl)Cl)Cl)Cl)C6(C(=C(C3(C6(Cl)Cl)Cl)Cl)Cl)Cl |
Product Overview
RefChem:71240 (CAS 84195-76-6), with molecular formula C20H5Cl14NO2 and molecular weight 780.60 g/mol. IUPAC: 1,4,5,6,7,10,11,16,17,18,19,19,20,20-tetradecachloro-12-nitrohexacyclo[14.2.1.14,7.02,15.03,8.09,14]icosa-5,9,11,13,17-pentaene.
Chemical Property Profile of RefChem:71240
Property Insights of RefChem:71240
The XLogP value of 11.0058 indicates that RefChem:71240 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.14 Ų, RefChem:71240 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:71240 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 RefChem:71240?
The CAS number of RefChem:71240 is 84195-76-6.
What is the molecular formula of RefChem:71240?
The molecular formula of RefChem:71240 is C20H5Cl14NO2.
What is the molecular weight of RefChem:71240?
The molecular weight of RefChem:71240 is 780.60 g/mol.
Where can I buy RefChem:71240?
You can request a quote for RefChem:71240 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:71240?
Yes, KEHONG BIO provides custom synthesis services for RefChem:71240 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.