C.I. Mordant Orange 29
TL;DR: C.I. Mordant Orange 29 (CAS 20352-64-1) is a chemical compound with molecular formula C16H13N5O7S and molecular weight 419.05356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-3-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]-5-nitrobenzenesulfonic acid
Also Known As: C.I. Mordant Orange 29, 2-Hydroxy-3-[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazenyl]-5-nitrobenzene-1-sulfonic acid, 2-hydroxy-3-[2-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazen-1-yl]-5-nitrobenzene-1-sulfonic acid, 3-[[(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol)-4-yl]azo]-2-hydroxy-5-nitrobenzenesulfonic acid
Technical Specifications
| Molecular Formula | C16H13N5O7S |
| Molecular Weight | 419.05356 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 186.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.05356 Da |
| Heavy Atoms | 29 |
| Complexity | 812.0 |
| SMILES | CC1=NN(C(=O)C1N=NC2=C(C(=CC(=C2)[N+](=O)[O-])S(=O)(=O)O)O)C3=CC=CC=C3 |
| InChIKey | VINQJSLQXMWMAD-UHFFFAOYSA-N |
Chemical Property Profile of C.I. Mordant Orange 29
Property Insights of C.I. Mordant Orange 29
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C.I. Mordant Orange 29. The TPSA of 186.0 Ų indicates high polarity, suggesting C.I. Mordant Orange 29 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C.I. Mordant Orange 29 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C.I. Mordant Orange 29?
The CAS number of C.I. Mordant Orange 29 is 20352-64-1.
What is the molecular formula of C.I. Mordant Orange 29?
The molecular formula of C.I. Mordant Orange 29 is C16H13N5O7S.
What is the molecular weight of C.I. Mordant Orange 29?
The molecular weight of C.I. Mordant Orange 29 is 419.05356 g/mol.
Where can I buy C.I. Mordant Orange 29?
You can request a quote for C.I. Mordant Orange 29 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C.I. Mordant Orange 29?
Yes, CoreyChem provides custom synthesis services for C.I. Mordant Orange 29 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.