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CAS 106-08-1 26-hydroxy-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl laurate molecular structure lightbox
CAS RN: 106-08-1

26-hydroxy-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl laurate

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Available package options are listed below.

1 package records1 with current stock
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250519 500ml / 2.5L / 10L Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS106-08-1
  • Purity/Analytical Methods: >99.0%
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106-08-1 / 2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl dodecanoate

Dodecanoic acid, 26-hydroxy-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl ester | 2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl dodecanoate | 26-hydroxy-3,6,9,12,15,18,21,24-octaoxahexacosyl dodecanoate

Standard CAS: 106-08-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
106-08-1
Multi CAS
Yes
Molecular Formula
C30H60O11
Molecular Weight
596.800000
Exact Mass
596.413563
SMILES
CCCCCCCCCCCC(=O)OCCOCCOCCOCCOCCOCCOCCOCCOCCO
InChI
InChI=1S/C30H60O11/c1-2-3-4-5-6-7-8-9-10-11-30(32)41-29-28-40-27-26-39-25-24-38-23-22-37-21-20-36-19-18-35-17-16-34-15-14-33-13-12-31/h31H,2-29H2,1H3
InChIKey
FGGVRPFJBBRZFG-UHFFFAOYSA-N
Synonyms
Dodecanoic acid, 26-hydroxy-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl ester 2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl dodecanoate 26-hydroxy-3,6,9,12,15,18,21,24-octaoxahexacosyl dodecanoate NSC1249 nonaethyleneglycol monolaurate

Computed Properties

Structural Parameters

Heavy atom count
41
Fraction Csp3
0.97
Rotatable bonds
36
H-bond acceptors
11
H-bond donors
1
Molar refractivity
156.44
TPSA
120.37

LogP / Solubility

WLOGP
3.58
MLOGP
3.19
XLogP3
3.4
Consensus LogP
3.39
Log S (ESOL)
-3.42
Class (ESOL)
Poorly soluble
Log S (Ali)
-7.04
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-10.83
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.82

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.56
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
4

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