CAS RN: 124495-18-7
Quinoxyfen
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250221 | 100mg | Out of stock | 5-7 business days | Inquiry |
- Product code: ICTQ0093
- Purity/Analytical Methods: >98.0%(GC)
124495-18-7 / 5,7-dichloro-4-(4-fluorophenoxy)quinoline
Basic Information
CAS
124495-18-7
Multi CAS
No
Molecular Formula
C15H8Cl2FNO
Molecular Weight
308.100000
Exact Mass
306.996697
SMILES
C1=CC(=CC=C1OC2=C3C(=CC(=CC3=NC=C2)Cl)Cl)F
InChI
InChI=1S/C15H8Cl2FNO/c16-9-7-12(17)15-13(8-9)19-6-5-14(15)20-11-3-1-10(18)2-4-11/h1-8H
InChIKey
WRPIRSINYZBGPK-UHFFFAOYSA-N
Physical Properties
Melting Point
105-106 °C
MP: 100-106 °C /Technical/
Density
1.56
Appearance
Crystals from heptane
Off-white solid
State
Solid
Storage Conditions
Avoid freezing. Store in original container only.
Keep out of reach of children. Store in a dry place, 0-30 °C. use only with adequate ventilation. Protect from heat. Store in original container. /Quintec Fungicide/
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
16
Rotatable bonds
2
H-bond acceptors
2
Molar refractivity
78.24
TPSA
22.12
LogP / Solubility
WLOGP
5.47
MLOGP
4.83
XLogP3
5.1
Consensus LogP
5.13
Log S (ESOL)
-5.66
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.04
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.45
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.71
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Safety & Transport
Pictogram(s)
Irritant
Environmental Hazard
Signal
Warning
GHS Hazard Statements
H317: May cause an allergic skin reaction [Warning Sensitization, Skin]
H400: Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
H410: Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
Precautionary Statement Codes
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501
