CAS RN: 1523618-22-5
2-(3-Aminooxetan-3-yl)ethanol oxalate(2:1)
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.20250909 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: SSC-062234
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
1523618-22-5 / bis(2-(3-aminooxetan-3-yl)ethanol);oxalic acid
Basic Information
CAS
1523618-22-5
Multi CAS
No
Molecular Formula
C12H24N2O8
Molecular Weight
324.330000
Exact Mass
324.153266
SMILES
C1C(CO1)(CCO)N.C1C(CO1)(CCO)N.C(=O)(C(=O)O)O
InChI
InChI=1S/2C5H11NO2.C2H2O4/c2*6-5(1-2-7)3-8-4-5;3-1(4)2(5)6/h2*7H,1-4,6H2;(H,3,4)(H,5,6)
InChIKey
BLHWKHZGQDLSFG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Fraction Csp3
0.83
Rotatable bonds
4
H-bond acceptors
8
H-bond donors
6
Molar refractivity
74.15
TPSA
185.56
LogP / Solubility
WLOGP
-2.65
MLOGP
-2.32
XLogP3
-2.65
Consensus LogP
-2.54
Log S (ESOL)
0.08
Class (ESOL)
Highly soluble
Log S (Ali)
-0.31
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.05
Class (SILICOS-IT)
Very 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)
-6.58
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5
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