CAS RN: 526-94-3
SODIUM BITARTRATE
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250425 | 25g / 100g / 500g | Confirm by inquiry | Shanghai, Shandong, Guangdong, Hebei | Inquiry |
- Product code: starshine_CAS526-94-3
- Purity/Analytical Methods: >99.0%
526-94-3 / sodium (2R,3R)-2,3,4-trihydroxy-4-oxobutanoate
Basic Information
CAS
526-94-3
Multi CAS
Yes
Molecular Formula
C4H5NAO6
Molecular Weight
172.070000
Exact Mass
171.998382
InChI
InChI=1S/C4H6O6.Na/c5-1(3(7)8)2(6)4(9)10;/h1-2,5-6H,(H,7,8)(H,9,10);/q;+1/p-1/t1-,2-;/m1./s1
InChIKey
NKAAEMMYHLFEFN-ZVGUSBNCSA-M
Physical Properties
Physical Description
Transparent colourless crystals
White solid; [Merck Index] White powder
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
5
H-bond donors
3
Molar refractivity
24.66
TPSA
117.89
LogP / Solubility
WLOGP
-6.45
MLOGP
-5.68
XLogP3
-6.45
Consensus LogP
-6.19
Log S (ESOL)
3.36
Class (ESOL)
Highly soluble
Log S (Ali)
3.69
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
4.22
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)
-8.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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