![CAS 1886967-00-5 3-Isopropylbicyclo[1.1.1]pentan-1-amine hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1886967-00-5.gif)
CAS RN: 1886967-00-5
3-Isopropylbicyclo[1.1.1]pentan-1-amine hydrochloride
Product Availability
Choose a grade to view its available package options.
4 package records3 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20251117 | 100mg / 1g | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-087812
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
- 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.
1886967-00-5 / 3-propan-2-ylbicyclo[1.1.1]pentan-1-amine;hydrochloride
Basic Information
CAS
1886967-00-5
Multi CAS
No
Molecular Formula
C8H16ClN
Molecular Weight
161.670000
Exact Mass
161.097127
SMILES
CC(C)C12CC(C1)(C2)N.Cl
InChI
InChI=1S/C8H15N.ClH/c1-6(2)7-3-8(9,4-7)5-7;/h6H,3-5,9H2,1-2H3;1H
InChIKey
NEAKIEVMLDPIOT-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
45.29
TPSA
26.02
LogP / Solubility
WLOGP
1.95
MLOGP
1.71
XLogP3
1.95
Consensus LogP
1.87
Log S (ESOL)
-2
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.29
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.45
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)
-2.32
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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
-
![CAS 1886967-09-4 N-methylbicyclo[1.1.1]pentan-1-amine hydrochloride molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
N-methylbicyclo[1.1.1]pentan-1-amine hydrochloride
- CAS RN: 1886967-09-4
- Product Code: SSC-087814
-
3-methanesulfonylbicyclo[1.1.1]pentan-1-amine
- CAS RN: 1886967-22-1
- Product Code: SSC-087817
-
3-chlorobicyclo[1.1.1]pentan-1-amine hydrochloride
- CAS RN: 1886967-25-4
- Product Code: SSC-087818
-
tert-butyl (3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl)carbamate
- CAS RN: 1886967-53-8
- Product Code: SSC-087821
-
-
2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetic acid
- CAS RN: 1886967-65-2
- Product Code: SSC-087825
![CAS 1886967-09-4 N-methylbicyclo[1.1.1]pentan-1-amine hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1886967-09-4.gif)
![CAS 1886967-22-1 3-methanesulfonylbicyclo[1.1.1]pentan-1-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1886967-22-1.gif)
![CAS 1886967-25-4 3-chlorobicyclo[1.1.1]pentan-1-amine hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1886967-25-4.gif)
![CAS 1886967-53-8 tert-butyl (3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl)carbamate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1886967-53-8.gif)
![CAS 1886967-57-2 3-tert-butylbicyclo[1.1.1]pentan-1-amine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1886967-57-2.gif)
![CAS 1886967-65-2 2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1886967-65-2.gif)