![CAS 49542-66-7 2-[[]2-[[]2-(3-aminopropoxy)ethoxy]ethoxy]ethanol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/49542-66-7.gif)
CAS RN: 49542-66-7
2-[[]2-[[]2-(3-aminopropoxy)ethoxy]ethoxy]ethanol
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.20251024 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-155763
Verified Factory Data
Supply Overview & Packaging Options
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
- Available purity: >95%
- Inventory rows with stock: 3
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
49542-66-7 / 2-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]ethanol
Basic Information
CAS
49542-66-7
Multi CAS
No
Molecular Formula
C9H21NO4
Molecular Weight
207.270000
Exact Mass
207.147058
InChI
InChI=1S/C9H21NO4/c10-2-1-4-12-6-8-14-9-7-13-5-3-11/h11H,1-10H2
InChIKey
SXDDDTPYWDCLCX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
1
Rotatable bonds
11
H-bond acceptors
5
H-bond donors
2
Molar refractivity
53.21
TPSA
73.94
LogP / Solubility
WLOGP
-0.62
MLOGP
-0.55
XLogP3
-1.5
Consensus LogP
-0.89
Log S (ESOL)
-0.01
Class (ESOL)
Very soluble
Log S (Ali)
-0.81
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-1.81
Class (SILICOS-IT)
Soluble
ADME
GI absorption
Low
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)
-4.43
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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