Einecs 221-387-4
TL;DR: Einecs 221-387-4 (CAS 3084-21-7) is a chemical compound with molecular formula C16H16Cl2N4O3 and molecular weight 382.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[(2,6-dichloro-4-nitrophenyl)diazenyl]-3-methylphenyl]methylamino]ethanol
Also Known As: C.I.Disperse Red 32, C.I. Disperse Red 32, 2-[[4-[(2,6-dichloro-4-nitrophenyl)azo]-3-methylphenyl]methylamino]ethanol, 2-((4-((2,6-Dichloro-4-nitrophenyl)azo)-3-methylphenyl)methylamino)ethanol, 2-({4-[(e)-(2,6-dichloro-4-nitrophenyl)diazenyl]-3-methylbenzyl}amino)ethanol
| Molecular Formula | C16H16Cl2N4O3 |
|---|---|
| Molecular Weight | 382.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.05994 |
| Heavy Atoms | 25 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 3084-21-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)CNCCO)N=NC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl |
| InChIKey | YRORXCTZJDBRQT-UHFFFAOYSA-N |
Product Overview
Einecs 221-387-4 (CAS 3084-21-7), with molecular formula C16H16Cl2N4O3 and molecular weight 382.06 g/mol. IUPAC: 2-[[4-[(2,6-dichloro-4-nitrophenyl)diazenyl]-3-methylphenyl]methylamino]ethanol.
Chemical Property Profile of Einecs 221-387-4
Property Insights of Einecs 221-387-4
The XLogP value of 3.8 indicates that Einecs 221-387-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 221-387-4. Following Lipinski's Rule of Five, Einecs 221-387-4 has 2 hydrogen bond donor(s) and 6 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 Einecs 221-387-4?
The CAS number of Einecs 221-387-4 is 3084-21-7.
What is the molecular formula of Einecs 221-387-4?
The molecular formula of Einecs 221-387-4 is C16H16Cl2N4O3.
What is the molecular weight of Einecs 221-387-4?
The molecular weight of Einecs 221-387-4 is 382.06 g/mol.
Where can I buy Einecs 221-387-4?
You can request a quote for Einecs 221-387-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 221-387-4?
Yes, KEHONG BIO provides custom synthesis services for Einecs 221-387-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.