CAS RN: 426-58-4
Phenyl Trifluoromethyl Sulfone
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250504 | 100g | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20250102 | 1g | In stock | Shanghai, Chengdu | Inquiry |
| Batchno.20250912 | 250mg | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
| Batchno.20251014 | 25g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250728 | 5g | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
- Product code: SSC-150920
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, 25g, 100g, 10g
- Available purity: >98%
- Inventory rows with stock: 4
- 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 | >98% | 5 In Stock | Hong Kong | Inquiry |
| 5g | >98% | 5 In Stock | Beijing | Inquiry |
| 25g | >98% | 4 In Stock | Shanghai | Inquiry |
| 100g | >98% | 1 In Stock | Beijing | Inquiry |
| 10g | >98% | 0 Out of Stock | Hong Kong | Inquiry |
426-58-4 / trifluoromethylsulfonylbenzene
Basic Information
CAS
426-58-4
Multi CAS
No
Molecular Formula
C7F3H5O2S
Molecular Weight
210.180000
Exact Mass
209.996235
InChI
InChI=1S/C7H5F3O2S/c8-7(9,10)13(11,12)6-4-2-1-3-5-6/h1-5H
InChIKey
UPGBQYFXKAKWQC-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
39.68
TPSA
34.14
LogP / Solubility
WLOGP
1.98
MLOGP
1.74
XLogP3
2.7
Consensus LogP
2.14
Log S (ESOL)
-2.67
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.71
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.79
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
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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