2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT
TL;DR: 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT (CAS 67102-97-0) is a chemical compound with molecular formula C20H6Cl13NO2 and molecular weight 746.63 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5,6,7,11,16,17,18,19,19,20,20-tridecachloro-12-nitrohexacyclo[14.2.1.14,7.02,15.03,8.09,14]icosa-5,9,11,13,17-pentaene
Also Known As: 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT, 1,2,3,4,5,6,7,8,10,13,13,14,14-Tridecachloro-11-nitro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene, 1,4,5,6,7,11,16,17,18,19,19,20,20-Tridecachloro-12-nitrohexacyclo[14.2.1.14,7.02,15.03,8.09,14]icosa-5,9,11,13,17-pentaene
| Molecular Formula | C20H6Cl13NO2 |
|---|---|
| Molecular Weight | 746.63 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 746.63495 |
| Heavy Atoms | 36 |
| Complexity | 1180.0 |
Chemical Identifiers
| CAS Number | 67102-97-0 |
|---|---|
| SMILES | C1=C2C3C(C4C(C2=CC(=C1[N+](=O)[O-])Cl)C5(C(=C(C4(C5(Cl)Cl)Cl)Cl)Cl)Cl)C6(C(=C(C3(C6(Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | KSAWMTRQDBHJKO-UHFFFAOYSA-N |
Product Overview
2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT (CAS 67102-97-0), with molecular formula C20H6Cl13NO2 and molecular weight 746.63 g/mol. IUPAC: 1,4,5,6,7,11,16,17,18,19,19,20,20-tridecachloro-12-nitrohexacyclo[14.2.1.14,7.02,15.03,8.09,14]icosa-5,9,11,13,17-pentaene.
Chemical Property Profile of 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT
Property Insights of 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT
The XLogP value of 8.3 indicates that 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT 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 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT?
The CAS number of 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT is 67102-97-0.
What is the molecular formula of 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT?
The molecular formula of 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT is C20H6Cl13NO2.
What is the molecular weight of 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT?
The molecular weight of 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT is 746.63 g/mol.
Where can I buy 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT?
You can request a quote for 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT?
Yes, KEHONG BIO provides custom synthesis services for 2-CHLORO-3-NITRONAPHTHALENE-BIS(HEXACHLOROCYCLOPENTADIENE) ADDUCT and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.