CAS RN: 86770-67-4
11-Azido-3,6,9-trioxaundecanol
Product Availability
Choose a grade to view its available package options.
8 package records8 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250410 | 100mg / 500mg / 1g / 5g / 25g | Confirm by inquiry | Shanghai, Shandong | 8-10 business days | Inquiry |
- Product code: ICTA2294
- Purity/Analytical Methods: >97.0%(GC)
86770-67-4 / 2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethanol
Basic Information
CAS
86770-67-4
Multi CAS
Yes
Molecular Formula
C8H17N3O4
Molecular Weight
219.240000
Exact Mass
219.121906
InChI
InChI=1S/C8H17N3O4/c9-11-10-1-3-13-5-7-15-8-6-14-4-2-12/h12H,1-8H2
InChIKey
MBQYGQMGPFNSAP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
11
H-bond acceptors
5
H-bond donors
1
Molar refractivity
53.56
TPSA
96.68
LogP / Solubility
WLOGP
0.34
MLOGP
0.3
Consensus LogP
0.21
Log S (ESOL)
-0.69
Class (ESOL)
Very soluble
Log S (Ali)
-1.6
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.69
Class (SILICOS-IT)
Moderately soluble
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
No
Log Kp (skin permeation)
-3.82
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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