![CAS 1626394-43-1 ethyl(1R,2S,3S,4R)-3-aminobicyclo[2.2.2]octane-2-carboxylatehydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1626394-43-1.gif)
CAS RN: 1626394-43-1
ethyl(1R,2S,3S,4R)-3-aminobicyclo[2.2.2]octane-2-carboxylatehydrochloride
Product Availability
Choose a grade to view its available package options.
7 package records7 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250928 | 100mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20251219 | 100mg / 250mg / 1g / 5g / 10g / 25g / 100g | Confirm by inquiry | Shanghai | Inquiry |
| Batchno.20251111 | 10g | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20250201 | 1g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20250723 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250627 | 25g | In stock | Tianjin | Inquiry |
| Batchno.20251123 | 5g | In stock | Shanghai | Inquiry |
- Product code: SSC-070058
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: ＞97%
- 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 | ＞97% | 0 Out of Stock | Shanghai | Inquiry |
1626394-43-1 / ethyl (2S,3S)-3-aminobicyclo[2.2.2]octane-2-carboxylate;hydrochloride
Basic Information
CAS
1626394-43-1
Multi CAS
No
Molecular Formula
C11H20ClNO2
Molecular Weight
233.730000
Exact Mass
233.118257
SMILES
CCOC(=O)[C@@H]1[C@H](C2CCC1CC2)N.Cl
InChI
InChI=1S/C11H19NO2.ClH/c1-2-14-11(13)9-7-3-5-8(6-4-7)10(9)12;/h7-10H,2-6,12H2,1H3;1H/t7?,8?,9-,10-;/m0./s1
InChIKey
CFRFVTFZTABHIF-UANYXRBSSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
0.91
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
60.79
TPSA
52.32
LogP / Solubility
WLOGP
1.73
MLOGP
1.53
XLogP3
1.73
Consensus LogP
1.66
Log S (ESOL)
-2.25
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.73
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.86
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)
-2.91
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
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