CAS RN: 463-11-6
1-Fluorooctane
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.20250801 | 1g / 5g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS463-11-6
- Purity/Analytical Methods: >99.0%
463-11-6 / 1-fluorooctane
Basic Information
CAS
463-11-6
Multi CAS
No
Molecular Formula
C8FH17
Molecular Weight
132.220000
Exact Mass
132.131429
InChI
InChI=1S/C8H17F/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3
InChIKey
DHIVLKMGKIZOHF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
6
H-bond acceptors
1
Molar refractivity
39.35
TPSA
0.0000
LogP / Solubility
WLOGP
3.32
MLOGP
2.91
XLogP3
4.5
Consensus LogP
3.58
Log S (ESOL)
-2.35
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.04
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.99
Class (SILICOS-IT)
Poorly 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)
-1.17
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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