CAS RN: 791061-00-2
Cyclobutanamine, 3,3-difluoro- (9CI)
Product Availability
Choose a grade to view its available package options.
3 package records0 with current stock1 grade group
- Product code: SSC-188334
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: 0.25g, 1g, 5g, 10g, 25g, 100g
- Available purity: >95%
- Inventory rows with stock: 1
- 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 |
|---|---|---|---|---|
| 0.25g | >95% | 1 In Stock | Shenzhen | Inquiry |
| 1g | >95% | 0 Out of Stock | Hong Kong | Inquiry |
| 5g | >95% | 0 Out of Stock | Beijing | Inquiry |
| 10g | >95% | 0 Out of Stock | Shanghai | Inquiry |
| 25g | >95% | 0 Out of Stock | Hong Kong | Inquiry |
| 100g | >95% | 0 Out of Stock | Beijing | Inquiry |
791061-00-2 / 3,3-difluorocyclobutan-1-amine
Basic Information
CAS
791061-00-2
Multi CAS
Yes
Molecular Formula
C4F2H7N
Molecular Weight
107.100000
Exact Mass
107.054656
InChI
InChI=1S/C4H7F2N/c5-4(6)1-3(7)2-4/h3H,1-2,7H2
InChIKey
RKATWUBDSJHPEV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
22.16
TPSA
26.02
LogP / Solubility
WLOGP
0.74
MLOGP
0.64
XLogP3
0.5
Consensus LogP
0.63
Log S (ESOL)
-0.97
Class (ESOL)
Very soluble
Log S (Ali)
-0.97
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.97
Class (SILICOS-IT)
Very 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)
-2.85
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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