![CAS 340023-03-2 {1-ethenyl-2-oxabicyclo[2.2.2]octan-4-yl}methanol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/340023-03-2.gif)
CAS RN: 340023-03-2
{1-ethenyl-2-oxabicyclo[2.2.2]octan-4-yl}methanol
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.20250407 | 100mg / 500mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS340023-03-2
- Purity/Analytical Methods: >99.0%
340023-03-2 / (1-ethenyl-2-oxabicyclo[2.2.2]octan-4-yl)methanol
Basic Information
CAS
340023-03-2
Multi CAS
No
Molecular Formula
C10H16O2
Molecular Weight
168.230000
Exact Mass
168.115030
InChI
InChI=1S/C10H16O2/c1-2-10-5-3-9(7-11,4-6-10)8-12-10/h2,11H,1,3-8H2
InChIKey
IPTTYNMDNSUNMR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.8
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
46.87
TPSA
29.46
LogP / Solubility
WLOGP
1.49
MLOGP
1.31
XLogP3
1
Consensus LogP
1.27
Log S (ESOL)
-1.69
Class (ESOL)
Soluble
Log S (Ali)
-2.02
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.23
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)
-2.69
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
3.5
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