CAS RN: 5325-43-9
Disodium 1,2-Ethanedisulfonate
Product Availability
Choose a grade to view its available package options.
3 package records3 with current stock1 grade group
- Product code: SSC-160469
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 25g
- Available purity: ≥97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 25g | ≥97% | 0 Out of Stock | Shanghai | Inquiry |
5325-43-9 / disodium;ethane-1,2-disulfonate
Basic Information
CAS
5325-43-9
Multi CAS
Yes
Molecular Formula
C2H4NA2O6S2
Molecular Weight
234.160000
Exact Mass
233.924469
InChI
InChI=1S/C2H6O6S2.2Na/c3-9(4,5)1-2-10(6,7)8;;/h1-2H2,(H,3,4,5)(H,6,7,8);;/q;2*+1/p-2
InChIKey
BJTHMUJCKBTCFR-UHFFFAOYSA-L
Computed Properties
Structural Parameters
Heavy atom count
12
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
6
Molar refractivity
29.13
TPSA
114.4
LogP / Solubility
WLOGP
-7.92
MLOGP
-6.96
XLogP3
-7.92
Consensus LogP
-7.6
Log S (ESOL)
3.89
Class (ESOL)
Highly soluble
Log S (Ali)
4.23
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
5.03
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-9.77
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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