CAS RN: 526-83-0
D(-)-Tartaric acid
Product Availability
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2 package records2 with current stock2 grade groups
- Product code: starshine_CAS526-83-0
- Purity/Analytical Methods: >99.0%
526-83-0 / 2,3-dihydroxybutanedioic acid
Basic Information
CAS
526-83-0
Multi CAS
Yes
Molecular Formula
C4H6O6
Molecular Weight
150.090000
Exact Mass
150.016438
InChI
InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)
InChIKey
FEWJPZIEWOKRBE-UHFFFAOYSA-N
Physical Properties
Physical Description
White solid; [ICSC] Colorless or white odorless solid; [JECFA] White odorless crystalline powder
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
4
Molar refractivity
27.29
TPSA
115.06
LogP / Solubility
WLOGP
-2.12
MLOGP
-1.87
XLogP3
-1.9
Consensus LogP
-1.96
Log S (ESOL)
0.76
Class (ESOL)
Highly soluble
Log S (Ali)
0.74
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.77
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)
-5.14
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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