![CAS 1215071-13-8 3-Azabicyclo[3.1.0]hexane, 6,6-difluoro-, hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1215071-13-8.gif)
CAS RN: 1215071-13-8
3-Azabicyclo[3.1.0]hexane, 6,6-difluoro-, hydrochloride
Product Availability
Choose a grade to view its available package options.
4 package records4 with current stock1 grade group
- Product code: SSC-024001
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, 10g, 0.1g, 25g, 5g
- Available purity: >98%
- Inventory rows with stock: 12
- 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 | -- | 5 In Stock | Shanghai | Inquiry |
| 0.25g | >98% | 5 In Stock | Hong Kong | Inquiry |
| 1g | -- | 3 In Stock | Shanghai | Inquiry |
| 1g | >98% | 3 In Stock | Beijing | Inquiry |
| 10g | -- | 3 In Stock | Shanghai | Inquiry |
| 10g | >98% | 3 In Stock | Beijing | Inquiry |
| 0.1g | -- | 2 In Stock | Shenzhen | Inquiry |
| 0.1g | >98% | 2 In Stock | Shenzhen | Inquiry |
| 25g | -- | 2 In Stock | Shenzhen | Inquiry |
| 25g | >98% | 2 In Stock | Shenzhen | Inquiry |
| 5g | -- | 1 In Stock | Shanghai | Inquiry |
| 5g | >98% | 1 In Stock | Hong Kong | Inquiry |
1215071-13-8 / 6,6-difluoro-3-azabicyclo[3.1.0]hexane;hydrochloride
Basic Information
CAS
1215071-13-8
Multi CAS
No
Molecular Formula
C5H8ClF2N
Molecular Weight
155.570000
Exact Mass
155.031333
SMILES
C1C2C(C2(F)F)CN1.Cl
InChI
InChI=1S/C5H7F2N.ClH/c6-5(7)3-1-8-2-4(3)5;/h3-4,8H,1-2H2;1H
InChIKey
BVCCCDHBLPVHFK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
32.04
TPSA
12.03
LogP / Solubility
WLOGP
0.89
MLOGP
0.78
XLogP3
0.89
Consensus LogP
0.85
Log S (ESOL)
-1.37
Class (ESOL)
Soluble
Log S (Ali)
-1.48
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.41
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)
-3.04
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Safety & Transport
Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Customers Also Viewed
-
tert-Butyl 3,3-difluoro-4-oxopyrrolidine-1-carboxylate
- CAS RN: 1215071-16-1
- Product Code: SSC-024003
-
tert-butyl 3,3-difluoro-4-oxopiperidine-1-carboxylate
- CAS RN: 1215071-17-2
- Product Code: starshine_CAS1215071-17-2
- Purity/Analytical method: >99.0%
-
-
-
-
1 – Fluoro – 3 – hydroxycyclobutanecarbonitrile
- CAS RN: 1215071-22-9
- Product Code: SSC-024007
