颜料黄111
TL;DR: 颜料黄111 (CAS 15993-42-7) is a chemical compound with molecular formula C18H17ClN4O6 and molecular weight 420.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
颜料黄111
N-(5-chloro-2-methoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide
Also Known As: Pigment Yellow 111, IRGALITE YELLOW F 4G, CI PIGMENT YELLOW 111, C.I. PIGMENT YELLOW 111, HY-D0511
| Molecular Formula | C18H17ClN4O6 |
|---|---|
| Molecular Weight | 420.08 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.08365 |
| Heavy Atoms | 29 |
| Complexity | 628.0 |
Chemical Identifiers
| CAS Number | 15993-42-7 |
|---|---|
| SMILES | CC(=O)C(C(=O)NC1=C(C=CC(=C1)Cl)OC)N=NC2=C(C=C(C=C2)[N+](=O)[O-])OC |
| InChIKey | AYOFXUHULUCJBF-UHFFFAOYSA-N |
Product Overview
颜料黄111 (CAS 15993-42-7), with molecular formula C18H17ClN4O6 and molecular weight 420.08 g/mol. IUPAC: N-(5-chloro-2-methoxyphenyl)-2-[(2-methoxy-4-nitrophenyl)diazenyl]-3-oxobutanamide.
Chemical Property Profile of 颜料黄111
Property Insights of 颜料黄111
The XLogP value of 3.9 indicates that 颜料黄111 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 颜料黄111. Following Lipinski's Rule of Five, 颜料黄111 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 颜料黄111?
The CAS number of 颜料黄111 is 15993-42-7.
What is the molecular formula of 颜料黄111?
The molecular formula of 颜料黄111 is C18H17ClN4O6.
What is the molecular weight of 颜料黄111?
The molecular weight of 颜料黄111 is 420.08 g/mol.
Where can I buy 颜料黄111?
You can request a quote for 颜料黄111 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 颜料黄111?
Yes, KEHONG BIO provides custom synthesis services for 颜料黄111 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.