CAS RN: 2086688-99-3
Acid-PEG2-t-butyl ester
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
| Batchno.20250616 |
50mg / 100mg / 250mg / 1g |
Confirm by inquiry |
Shanghai | 5-7 business days | Inquiry |
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Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 0.25g, 1g, 5g, 10g
- Available purity: >97%
- Inventory rows with stock: 5
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 2086688-99-3
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 0.1g |
>97% |
2
In Stock
|
Shanghai |
Inquiry |
| 0.25g |
>97% |
2
In Stock
|
Shenzhen |
Inquiry |
| 1g |
>97% |
2
In Stock
|
Beijing |
Inquiry |
| 5g |
>97% |
1
In Stock
|
Hong Kong |
Inquiry |
| 10g |
>97% |
1
In Stock
|
Beijing |
Inquiry |
2086688-99-3 / 3-[2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropoxy]ethoxy]propanoic acid
Standard CAS: 2086688-99-3
Multi CAS: No
Basic Information
CAS
2086688-99-3
Multi CAS
No
Molecular Formula
C12H22O6
Molecular Weight
262.300000
Exact Mass
262.141638
SMILES
CC(C)(C)OC(=O)CCOCCOCCC(=O)O
InChI
InChI=1S/C12H22O6/c1-12(2,3)18-11(15)5-7-17-9-8-16-6-4-10(13)14/h4-9H2,1-3H3,(H,13,14)
InChIKey
FVMOAKLTZMCDOV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
18
Fraction Csp3
0.83
Rotatable bonds
9
H-bond acceptors
5
H-bond donors
1
Molar refractivity
64.35
TPSA
82.06
LogP / Solubility
WLOGP
1.23
MLOGP
1.09
XLogP3
0.2
Consensus LogP
0.84
Log S (ESOL)
-1.64
Class (ESOL)
Soluble
Log S (Ali)
-2.6
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.46
Class (SILICOS-IT)
Poorly 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)
-3.45
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5