![CAS 170011-47-9 1,4-dioxaspiro[4.5]dec-7-en-8-yl trifluoromethanesulfonate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/170011-47-9.gif)
CAS RN: 170011-47-9
1,4-dioxaspiro[4.5]dec-7-en-8-yl trifluoromethanesulfonate
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260526 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250913 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20251104 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250817 | 250mg / 1g | Out of stock | 30 business days | Inquiry | |
| Batchno.20260402 | 5g | In stock | Shanghai | Inquiry |
- Product code: SSC-074623
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: 1g, 5g, 0.1g, 0.25g, 10g
- Available purity: >95%
- Inventory rows with stock: 5
- 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.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | >95% | 4 In Stock | Hong Kong | Inquiry |
| 5g | >95% | 3 In Stock | Beijing | Inquiry |
| 0.1g | >95% | 2 In Stock | Shenzhen | Inquiry |
| 0.25g | >95% | 2 In Stock | Shenzhen | Inquiry |
| 10g | >95% | 2 In Stock | Beijing | Inquiry |
170011-47-9 / 1,4-dioxaspiro[4.5]dec-7-en-8-yl trifluoromethanesulfonate
Basic Information
CAS
170011-47-9
Multi CAS
No
Molecular Formula
C9H11F3O5S
Molecular Weight
288.240000
Exact Mass
288.027929
SMILES
C1CC2(CC=C1OS(=O)(=O)C(F)(F)F)OCCO2
InChI
InChI=1S/C9H11F3O5S/c10-9(11,12)18(13,14)17-7-1-3-8(4-2-7)15-5-6-16-8/h1H,2-6H2
InChIKey
NOLMGELTBIIGOL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Fraction Csp3
0.78
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
52.63
TPSA
61.83
LogP / Solubility
WLOGP
1.66
MLOGP
1.47
XLogP3
1.7
Consensus LogP
1.61
Log S (ESOL)
-2.54
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.12
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.15
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)
-3.3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
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