EINECS 246-683-0
TL;DR: EINECS 246-683-0 (CAS 25158-37-6) is a chemical compound with molecular formula C32H38N2O8S2 and molecular weight 642.207 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-amino-4-(4-dodecoxysulfonylanilino)-9,10-dioxoanthracene-2-sulfonic acid
Also Known As: 1-Amino-4-(4-dodecylsulphoanilino)-9,10-dihydro-9,10-dioxoanthracene-2-sulphonic acid, 1-amino-4-({4-[(dodecyloxy)sulfonyl]phenyl}amino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid, 1-Amino-4-[(4-dodecylsulfophenyl)amino]-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid, 1-amino-4-(4-dodecoxysulfonylanilino)-9,10-dioxoanthracene-2-sulfonic acid, 1-Amino-4-(4-dodecylsulfoanilino)-9,10-dihydro-9,10-dioxoanthracene-2-sulfonic acid
Technical Specifications
| Molecular Formula | C32H38N2O8S2 |
| Molecular Weight | 642.207 g/mol |
| XLogP | 8.4 |
| Topological Polar Surface Area (TPSA) | 187.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 16 |
| Exact Mass | 642.207 Da |
| Heavy Atoms | 44 |
| Complexity | 1160.0 |
| SMILES | CCCCCCCCCCCCOS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O |
| InChIKey | ZPDWLYNZGQJXIE-UHFFFAOYSA-N |
Chemical Property Profile of EINECS 246-683-0
Property Insights of EINECS 246-683-0
The XLogP value of 8.4 indicates that EINECS 246-683-0 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 187.0 Ų indicates high polarity, suggesting EINECS 246-683-0 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 246-683-0 has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of EINECS 246-683-0?
The CAS number of EINECS 246-683-0 is 25158-37-6.
What is the molecular formula of EINECS 246-683-0?
The molecular formula of EINECS 246-683-0 is C32H38N2O8S2.
What is the molecular weight of EINECS 246-683-0?
The molecular weight of EINECS 246-683-0 is 642.207 g/mol.
Where can I buy EINECS 246-683-0?
You can request a quote for EINECS 246-683-0 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for EINECS 246-683-0?
Yes, CoreyChem provides custom synthesis services for EINECS 246-683-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.