RefChem:310069
TL;DR: RefChem:310069 (CAS 71130-67-1) is a chemical compound with molecular formula C20H12Cl3N5O9S3 and molecular weight 666.8863 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-[[4-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl]diazenyl]naphthalene-1,3,5-trisulfonic acid
Also Known As: 1,3,5-Naphthalenetrisulfonic acid, 7-((4-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)azo)-, 1,3,5-Naphthalenetrisulfonic acid, 7-[[4-[(2,5,6-trichloro-4-pyrimidinyl)amino]phenyl]azo]-, 7-[(e)-{4-[(2,5,6-trichloropyrimidin-4-yl)amino]phenyl}diazenyl]naphthalene-1,3,5-trisulfonic acid, 7-[[4-[ amino]phenyl]azo]-1,3,5-naphthalenetrisulfonicacid, 1,3,5-Naphthalenetrisulfonic acid, 7-(2-(4-((2,5,6-trichloro-4-pyrimidinyl)amino)phenyl)diazenyl)-
Technical Specifications
| Molecular Formula | C20H12Cl3N5O9S3 |
| Molecular Weight | 666.8863 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 251.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 666.8863 Da |
| Heavy Atoms | 40 |
| Complexity | 1250.0 |
| SMILES | C1=CC(=CC=C1NC2=C(C(=NC(=N2)Cl)Cl)Cl)N=NC3=CC4=C(C=C(C=C4S(=O)(=O)O)S(=O)(=O)O)C(=C3)S(=O)(=O)O |
| InChIKey | ACQHNCUFSICMOJ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:310069
Property Insights of RefChem:310069
The XLogP value of 3.9 indicates that RefChem:310069 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 251.0 Ų indicates high polarity, suggesting RefChem:310069 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:310069 has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:310069?
The CAS number of RefChem:310069 is 71130-67-1.
What is the molecular formula of RefChem:310069?
The molecular formula of RefChem:310069 is C20H12Cl3N5O9S3.
What is the molecular weight of RefChem:310069?
The molecular weight of RefChem:310069 is 666.8863 g/mol.
Where can I buy RefChem:310069?
You can request a quote for RefChem:310069 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:310069?
Yes, CoreyChem provides custom synthesis services for RefChem:310069 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.