CAS RN: 1059189-65-9
m-PEG4-CH2-aldehyde
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250724 | 100mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1059189-65-9
- Purity/Analytical Methods: >99.0%
1059189-65-9 / 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetaldehyde
m-PEG4-CH2-aldehyde | mPEG4-CH2CHO | 2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetaldehyde
Basic Information
CAS
1059189-65-9
Multi CAS
Yes
Molecular Formula
C11H22O6
Molecular Weight
250.290000
Exact Mass
250.141638
SMILES
COCCOCCOCCOCCOCC=O
InChI
InChI=1S/C11H22O6/c1-13-4-5-15-8-9-17-11-10-16-7-6-14-3-2-12/h2H,3-11H2,1H3
InChIKey
PERZZOPFAPJECS-UHFFFAOYSA-N
Synonyms
m-PEG4-CH2-aldehyde
mPEG4-CH2CHO
2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]acetaldehyde
orb1989179
SCHEMBL29256269
Computed Properties
Structural Parameters
Heavy atom count
17
Fraction Csp3
0.91
Rotatable bonds
14
H-bond acceptors
6
Molar refractivity
61.22
TPSA
63.22
LogP / Solubility
WLOGP
-0.1
MLOGP
-0.08
XLogP3
-1
Consensus LogP
-0.39
Log S (ESOL)
-0.4
Class (ESOL)
Very soluble
Log S (Ali)
-1.54
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.88
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.32
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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