CAS RN: 463-23-0
1-fluoro-9-chlorononane
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.20260420 | 5g / 25g / 100g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS463-23-0
- Purity/Analytical Methods: >99.0%
463-23-0 / 1-chloro-9-fluorononane
Basic Information
CAS
463-23-0
Multi CAS
Yes
Molecular Formula
C9H18CLF
Molecular Weight
180.690000
Exact Mass
180.108106
InChI
InChI=1S/C9H18ClF/c10-8-6-4-2-1-3-5-7-9-11/h1-9H2
InChIKey
IZWJXXYDFODIDQ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
1
Rotatable bonds
8
H-bond acceptors
1
Molar refractivity
49.01
TPSA
0.0000
LogP / Solubility
WLOGP
3.93
MLOGP
3.45
XLogP3
4.2
Consensus LogP
3.86
Log S (ESOL)
-2.91
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.88
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-5.05
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.04
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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