![CAS 1779942-70-9 8,8-Difluoro-3-azabicyclo[3.2.1]octane hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1779942-70-9.gif)
CAS RN: 1779942-70-9
8,8-Difluoro-3-azabicyclo[3.2.1]octane hydrochloride
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.20260227 | 100mg / 250mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-077923
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 | Hong Kong | Inquiry |
1779942-70-9 / 8,8-difluoro-3-azabicyclo[3.2.1]octane;hydrochloride
Basic Information
CAS
1779942-70-9
Multi CAS
No
Molecular Formula
C7H12ClF2N
Molecular Weight
183.630000
Exact Mass
183.062633
SMILES
C1CC2CNCC1C2(F)F.Cl
InChI
InChI=1S/C7H11F2N.ClH/c8-7(9)5-1-2-6(7)4-10-3-5;/h5-6,10H,1-4H2;1H
InChIKey
XYZIFKBGKWQVOP-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
41.28
TPSA
12.03
LogP / Solubility
WLOGP
1.67
MLOGP
1.47
XLogP3
1.67
Consensus LogP
1.6
Log S (ESOL)
-2.03
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.27
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.24
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)
-2.65
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
4.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Customers Also Viewed
-
methyl 3,3-difluoropiperidine-4-carboxylate hydrochloride
- CAS RN: 1779974-06-9
- Product Code: SSC-077934
-
(5-Trifluoromethyl-imidazo[1,2-a]pyridin-2-yl)-methanol
- CAS RN: 1779974-61-6
- Product Code: starshine_CAS1779974-61-6
- Purity/Analytical method: >99.0%
-
1-Azetidinecarboxylic acid, 3-(hydroxymethyl)-3-methoxy-,1,1-dimethylethyl ester
- CAS RN: 1779977-63-7
- Product Code: SSC-077936
-
1,3-Piperidinedicarboxylic acid, 6-oxo-, 1-(1,1-dimethylethyl) ester
- CAS RN: 1779990-74-7
- Product Code: SSC-077938
-
3-Chloro-8-methoxy-imidazo[1,2-a]pyrazine
- CAS RN: 1780010-11-8
- Product Code: starshine_CAS1780010-11-8
- Purity/Analytical method: >99.0%
-
6-(Methylsulfonyl)picolinaldehyde
- CAS RN: 1780013-94-6
- Product Code: starshine_CAS1780013-94-6
- Purity/Analytical method: >99.0%
![CAS 1779974-61-6 (5-Trifluoromethyl-imidazo[1,2-a]pyridin-2-yl)-methanol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1779974-61-6.gif)
![CAS 1780010-11-8 3-Chloro-8-methoxy-imidazo[1,2-a]pyrazine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1780010-11-8.gif)
