![CAS 192870-65-8 8-(2-PROPENYLOXY)-1,4-DIOXASPIRO[4.5]DECANE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/192870-65-8.gif)
CAS RN: 192870-65-8
8-(2-PROPENYLOXY)-1,4-DIOXASPIRO[4.5]DECANE
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.20260312 | 250mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS192870-65-8
- Purity/Analytical Methods: >99.0%
192870-65-8 / 8-prop-2-enoxy-1,4-dioxaspiro[4.5]decane
Basic Information
CAS
192870-65-8
Multi CAS
No
Molecular Formula
C11H18O3
Molecular Weight
198.260000
Exact Mass
198.125594
SMILES
C=CCOC1CCC2(CC1)OCCO2
InChI
InChI=1S/C11H18O3/c1-2-7-12-10-3-5-11(6-4-10)13-8-9-14-11/h2,10H,1,3-9H2
InChIKey
MHAWOYYSJZHFFA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
0.82
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
53.04
TPSA
27.69
LogP / Solubility
WLOGP
1.87
MLOGP
1.65
XLogP3
1.5
Consensus LogP
1.67
Log S (ESOL)
-2.05
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.54
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.86
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)
-2.6
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
2.5
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