CAS RN: 1308644-71-4
(3-fluorooxetan-3-yl)Methyl 4-Methylbenzenesulfonate
Product Availability
Choose a grade to view its available package options.
5 package records2 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260613 | 100mg | In stock | Shanghai, Shenzhen, Wuhan, Chengdu | Inquiry | |
| Batchno.20250801 | 1g | Out of stock | Inquiry | ||
| Batchno.20251104 | 250mg | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20250718 | 50mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20260519 | 5g | Out of stock | Inquiry |
- Product code: SSC-037404
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: 0.1g, 0.25g, 1g, 5g, 10g, 25g, 50g, 100g, 250g
- Available purity: ≥95%
- Inventory rows with stock: 9
- 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 |
|---|---|---|---|---|
| 0.1g | ≥95% | 5 In Stock | Beijing | Inquiry |
| 0.25g | ≥95% | 5 In Stock | Hong Kong | Inquiry |
| 1g | ≥95% | 5 In Stock | Beijing | Inquiry |
| 5g | ≥95% | 5 In Stock | Shanghai | Inquiry |
| 10g | ≥95% | 5 In Stock | Beijing | Inquiry |
| 25g | ≥95% | 5 In Stock | Beijing | Inquiry |
| 50g | ≥95% | 5 In Stock | Hong Kong | Inquiry |
| 100g | ≥95% | 5 In Stock | Hong Kong | Inquiry |
| 250g | ≥95% | 5 In Stock | Hong Kong | Inquiry |
1308644-71-4 / (3-fluorooxetan-3-yl)methyl 4-methylbenzenesulfonate
Basic Information
CAS
1308644-71-4
Multi CAS
No
Molecular Formula
C11H13FO4S
Molecular Weight
260.280000
Exact Mass
260.051858
SMILES
CC1=CC=C(C=C1)S(=O)(=O)OCC2(COC2)F
InChI
InChI=1S/C11H13FO4S/c1-9-2-4-10(5-3-9)17(13,14)16-8-11(12)6-15-7-11/h2-5H,6-8H2,1H3
InChIKey
VKVRJIRYDHEVTB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
4
H-bond acceptors
4
Molar refractivity
58.97
TPSA
52.6
LogP / Solubility
WLOGP
1.44
MLOGP
1.27
XLogP3
1.3
Consensus LogP
1.34
Log S (ESOL)
-2.36
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.73
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.03
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)
-3.29
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
1.5
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