CAS RN: 2086689-03-2
Aminooxy-PEG3-methyl ester
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.20251113 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS2086689-03-2
- Purity/Analytical Methods: >99.0%
2086689-03-2 / methyl 3-[2-[2-(2-aminooxyethoxy)ethoxy]ethoxy]propanoate
Basic Information
CAS
2086689-03-2
Multi CAS
No
Molecular Formula
C10H21NO6
Molecular Weight
251.280000
Exact Mass
251.136887
SMILES
COC(=O)CCOCCOCCOCCON
InChI
InChI=1S/C10H21NO6/c1-13-10(12)2-3-14-4-5-15-6-7-16-8-9-17-11/h2-9,11H2,1H3
InChIKey
KYJYDNKATOCUIR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Fraction Csp3
0.9
Rotatable bonds
12
H-bond acceptors
7
H-bond donors
1
Molar refractivity
59.23
TPSA
89.24
LogP / Solubility
WLOGP
-0.51
MLOGP
-0.44
XLogP3
-1.3
Consensus LogP
-0.75
Log S (ESOL)
-0.28
Class (ESOL)
Very soluble
Log S (Ali)
-1.25
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.31
Class (SILICOS-IT)
Moderately 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)
-4.62
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
Customers Also Viewed
-
N-(Azido-PEG2)-N-Fluorescein-PEG3-acid
- CAS RN: 2086689-04-3
- Product Code: starshine_CAS2086689-04-3
- Purity/Analytical method: >99.0%
-
2-(Azido-PEG3-amido)-1,3-bis(carboxylethoxy)propane
- CAS RN: 2086689-05-4
- Product Code: SSC-098055
-
-
tert-Butyl 2-(2-Ethynyl-2-methyl-1-pyrrolidinyl)acetate
- CAS RN: 2086689-87-2
- Product Code: SSC-098058
-
NDI12-4Br
- CAS RN: 2086725-21-3
- Product Code: starshine_CAS2086725-21-3
- Purity/Analytical method: >99.0%
-
