![CAS 2408959-03-3 2,2-Difluoro-6-azaspiro[3.4]octane hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2408959-03-3.gif)
CAS RN: 2408959-03-3
2,2-Difluoro-6-azaspiro[3.4]octane hydrochloride
- Product code: SSC-117341
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, 5g, 10g
- Available purity: >97%
- Inventory rows with stock: 4
- 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.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 0.1g | >97% | 1 In Stock | Beijing | Inquiry |
| 0.25g | >97% | 1 In Stock | Shenzhen | Inquiry |
| 1g | >97% | 1 In Stock | Shenzhen | Inquiry |
| 5g | >97% | 1 In Stock | Shanghai | Inquiry |
| 10g | >97% | 0 Out of Stock | Shanghai | Inquiry |
2408959-03-3 / 2,2-difluoro-6-azaspiro[3.4]octane;hydrochloride
Basic Information
CAS
2408959-03-3
Multi CAS
No
Molecular Formula
C7H12ClF2N
Molecular Weight
183.630000
Exact Mass
183.062633
SMILES
C1CNCC12CC(C2)(F)F.Cl
InChI
InChI=1S/C7H11F2N.ClH/c8-7(9)3-6(4-7)1-2-10-5-6;/h10H,1-5H2;1H
InChIKey
VAUQHXIBZXNWBT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
41.35
TPSA
12.03
LogP / Solubility
WLOGP
1.82
MLOGP
1.6
XLogP3
1.82
Consensus LogP
1.75
Log S (ESOL)
-2.12
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.38
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.36
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)
-2.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
![CAS 2408959-99-7 {1H-pyrrolo[3,2-c]pyridin-2-yl}methanamine dihydrochloride molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
{1H-pyrrolo[3,2-c]pyridin-2-yl}methanamine dihydrochloride
- CAS RN: 2408959-99-7
- Product Code: starshine_CAS2408959-99-7
- Purity/Analytical method: >99.0%
-
2,6-Piperidinedione, 3-(5-bromo-6-fluoro-1,3-dihydro-1-oxo-2H-isoindol-2-yl)-
- CAS RN: 2409005-96-3
- Product Code: SSC-117393
-
-
4H-1,2,4-Triazole, 3-[[3-(3-bromophenyl)-3-oxetanyl]methyl]-4-methyl-
- CAS RN: 2409548-28-1
- Product Code: SSC-117411
-
((2R,6R)-6-methylmorpholin-2-yl)methanol HCl
- CAS RN: 2409588-87-8
- Product Code: starshine_CAS2409588-87-8
- Purity/Analytical method: >99.0%
-
(2R,4R)-(2-Methyl-piperidin-4-yl)-carbamic acid benzyl ester
- CAS RN: 2409589-97-3
- Product Code: starshine_CAS2409589-97-3
- Purity/Analytical method: >99.0%
![CAS 2408959-99-7 {1H-pyrrolo[3,2-c]pyridin-2-yl}methanamine dihydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2408959-99-7.gif)
![CAS 2409548-28-1 4H-1,2,4-Triazole, 3-[[3-(3-bromophenyl)-3-oxetanyl]methyl]-4-methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2409548-28-1.gif)
