RefChem:216425
TL;DR: RefChem:216425 (CAS 67827-62-7) is a chemical compound with molecular formula C22H22ClN5O8 and molecular weight 519.11566 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[4-[(2-chloro-4,6-dinitrophenyl)diazenyl]naphthalen-1-yl]-(2,3-dihydroxypropyl)amino]propane-1,2-diol
Also Known As: 3,3'-((4-((2-Chloro-4,6-dinitrophenyl)azo)naphthyl)imino)bispropane-1,2-diol, 1,2-Propanediol, 3,3'-[[4-[(2-chloro-4,6-dinitrophenyl)azo]-1-naphthalenyl]imino]bis-, 3,3'-[[4-[(2-CHLORO-4,6-DINITROPHENYL)AZO]NAPHTHYL]IMINO]BISPROPANE-1,2-DIOL, 3,3'-((4-((2-Chloro-4,6-dinitrophenyl)diazenyl)naphthalen-1-yl)azanediyl)bis(propane-1,2-diol), 3-({4-[(1E)-2-(2-chloro-4,6-dinitrophenyl)diazen-1-yl]naphthalen-1-yl}(2,3-dihydroxypropyl)amino)propane-1,2-diol
Technical Specifications
| Molecular Formula | C22H22ClN5O8 |
| Molecular Weight | 519.11566 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 201.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 519.11566 Da |
| Heavy Atoms | 36 |
| Complexity | 756.0 |
| SMILES | C1=CC=C2C(=C1)C(=CC=C2N(CC(CO)O)CC(CO)O)N=NC3=C(C=C(C=C3Cl)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | AIPKWLSKNQFYJL-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:216425
Property Insights of RefChem:216425
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:216425. The TPSA of 201.0 Ų indicates high polarity, suggesting RefChem:216425 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:216425 has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:216425?
The CAS number of RefChem:216425 is 67827-62-7.
What is the molecular formula of RefChem:216425?
The molecular formula of RefChem:216425 is C22H22ClN5O8.
What is the molecular weight of RefChem:216425?
The molecular weight of RefChem:216425 is 519.11566 g/mol.
Where can I buy RefChem:216425?
You can request a quote for RefChem:216425 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:216425?
Yes, CoreyChem provides custom synthesis services for RefChem:216425 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.