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CAS 381716-41-2 Lithium DL-2-Hydroxybutyrate molecular structure lightbox
CAS RN: 381716-41-2

Lithium DL-2-Hydroxybutyrate

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250426 25g In stock Inquiry
Batchno.20251210 5g Out of stock 8-10 business days Inquiry
Batchno.20251219 5g In stock Inquiry
  • Product code: ICTH0580
  • Purity/Analytical Methods: >98.0%(T)
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381716-41-2 / lithium 2-hydroxybutanoate

Standard CAS: 381716-41-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
381716-41-2
Multi CAS
Yes
Molecular Formula
C4H7LiO3
Molecular Weight
110.100000
Exact Mass
110.055523
InChI
InChI=1S/C4H8O3.Li/c1-2-3(5)4(6)7;/h3,5H,2H2,1H3,(H,6,7);/q;+1/p-1
InChIKey
CILZBARDXHWUSX-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
8
Fraction Csp3
0.75
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
21.3
TPSA
60.36

LogP / Solubility

WLOGP
-4.49
MLOGP
-3.96
XLogP3
-4.49
Consensus LogP
-4.31
Log S (ESOL)
2.44
Class (ESOL)
Highly soluble
Log S (Ali)
2.78
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
3.11
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)
-6.58

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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