![CAS 2092067-90-6 2-{3-fluorobicyclo[1.1.1]pentan-1-yl}acetic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2092067-90-6.png)
CAS RN: 2092067-90-6
2-{3-fluorobicyclo[1.1.1]pentan-1-yl}acetic acid
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250509 | 100mg | Out of stock | 15 business days | Inquiry | |
| Batchno.20250829 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260306 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20251125 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20260624 | 50mg | In stock | Shanghai | Inquiry |
- Product code: SSC-098895
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: 0.25g
- 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 |
|---|---|---|---|---|
| 0.25g | ＞97% | 0 Out of Stock | Beijing | Inquiry |
2092067-90-6 / 2-(3-fluoro-1-bicyclo[1.1.1]pentanyl)acetic acid
Basic Information
CAS
2092067-90-6
Multi CAS
No
Molecular Formula
C7H9FO2
Molecular Weight
144.140000
Exact Mass
144.058658
SMILES
C1C2(CC1(C2)F)CC(=O)O
InChI
InChI=1S/C7H9FO2/c8-7-2-6(3-7,4-7)1-5(9)10/h1-4H2,(H,9,10)
InChIKey
ILSROMXOKVNCAB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.86
Rotatable bonds
2
H-bond acceptors
1
H-bond donors
1
Molar refractivity
32.38
TPSA
37.3
LogP / Solubility
WLOGP
1.35
MLOGP
1.18
XLogP3
0.7
Consensus LogP
1.08
Log S (ESOL)
-1.45
Class (ESOL)
Soluble
Log S (Ali)
-1.72
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.96
Class (SILICOS-IT)
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)
-2.64
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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