![CAS 67594-61-0 Spiro[bicyclo[2.2.1]heptane-2,2’-[1,3]dioxolan]-5-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/67594-61-0.gif)
CAS RN: 67594-61-0
Spiro[bicyclo[2.2.1]heptane-2,2’-[1,3]dioxolan]-5-one
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.20251009 | 100mg / 250mg / 500mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-177290
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 5g, 1g, 0.1g, 0.25g
- Available purity: >97%
- Inventory rows with stock: 2
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
67594-61-0 / (1'R,4'R)-spiro[1,3-dioxolane-2,5'-bicyclo[2.2.1]heptane]-2'-one
Basic Information
CAS
67594-61-0
Multi CAS
Yes
Molecular Formula
C9H12O3
Molecular Weight
168.190000
Exact Mass
168.078644
InChI
InChI=1S/C9H12O3/c10-8-4-7-3-6(8)5-9(7)11-1-2-12-9/h6-7H,1-5H2/t6-,7-/m1/s1
InChIKey
AHODDELHXDJTTC-RNFRBKRXSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
0.89
H-bond acceptors
3
Molar refractivity
40.47
TPSA
35.53
LogP / Solubility
WLOGP
0.73
MLOGP
0.64
XLogP3
-0.1
Consensus LogP
0.42
Log S (ESOL)
-1.34
Class (ESOL)
Soluble
Log S (Ali)
-1.47
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.36
Class (SILICOS-IT)
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)
-3.23
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5.5
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![CAS 67595-99-7 Nickel, [[4,4′,4”,4”’-(21H,23H-porphine-5,10,15,20-tetrayl-κN21,κN22,κN23,κN24)tetrakis[benzenaminato]](2-)]-, (SP-4-1)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/67595-99-7.gif)
