CAS RN: 393165-20-3
ALPHA-CHLORO-4-FLUOROBENZALDOXIME
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.20250104 | 25g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS393165-20-3
- Purity/Analytical Methods: >99.0%
393165-20-3 / 4-fluoro-N-hydroxybenzenecarboximidoyl chloride
Basic Information
CAS
393165-20-3
Multi CAS
Yes
Molecular Formula
C7H5CLFNO
Molecular Weight
173.570000
Exact Mass
173.004370
InChI
InChI=1S/C7H5ClFNO/c8-7(10-11)5-1-3-6(9)4-2-5/h1-4,11H
InChIKey
VDMJCVUEUHKGOY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
40.58
TPSA
32.59
LogP / Solubility
WLOGP
2.2
MLOGP
1.93
XLogP3
2.8
Consensus LogP
2.31
Log S (ESOL)
-2.64
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.57
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.73
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.22
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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