![CAS 56327-24-3 8-Phenyl-1,4-dioxaspiro[4.5]decane-8-carbaldehyde molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/56327-24-3.gif)
CAS RN: 56327-24-3
8-Phenyl-1,4-dioxaspiro[4.5]decane-8-carbaldehyde
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.20251218 | 500mg / 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS56327-24-3
- Purity/Analytical Methods: >99.0%
56327-24-3 / 8-phenyl-1,4-dioxaspiro[4.5]decane-8-carbaldehyde
Basic Information
CAS
56327-24-3
Multi CAS
No
Molecular Formula
C15H18O3
Molecular Weight
246.300000
Exact Mass
246.125594
InChI
InChI=1S/C15H18O3/c16-12-14(13-4-2-1-3-5-13)6-8-15(9-7-14)17-10-11-18-15/h1-5,12H,6-11H2
InChIKey
NWJJFBSWKAAPNW-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
6
Fraction Csp3
0.53
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
67.29
TPSA
35.53
LogP / Solubility
WLOGP
2.44
MLOGP
2.15
XLogP3
1.8
Consensus LogP
2.13
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.34
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.53
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)
-2.49
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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