CAS RN: 557-59-5
Lignoceric Acid
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250812 | 100mg | In stock | Shanghai | Inquiry |
- Product code: ICTT0076
- Purity/Analytical Methods: >96.0%(T)
557-59-5 / tetracosanoic acid
Basic Information
CAS
557-59-5
Multi CAS
No
Molecular Formula
C24H48O2
Molecular Weight
368.600000
Exact Mass
368.365431
InChI
InChI=1S/C24H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h2-23H2,1H3,(H,25,26)
InChIKey
QZZGJDVWLFXDLK-UHFFFAOYSA-N
Physical Properties
Melting Point
84.2 °C
Physical Description
Solid; [Merck Index] White solid;
Solid
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
26
Fraction Csp3
0.96
Rotatable bonds
22
H-bond acceptors
1
H-bond donors
1
Molar refractivity
114.88
TPSA
37.3
LogP / Solubility
WLOGP
8.67
MLOGP
7.65
XLogP3
10.7
Consensus LogP
9.01
Log S (ESOL)
-6.14
Class (ESOL)
Insoluble
Log S (Ali)
-8.84
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-11.89
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
1.19
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
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- Purity/Analytical method: >98.0%(T)
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