![CAS 871658-02-5 2-Azabicyclo[2.1.1]hexane hydrochloride molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/871658-02-5.gif)
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: 5
- 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% | 5 In Stock | Hong Kong | Inquiry |
| 0.25g | >97% | 5 In Stock | Hong Kong | Inquiry |
| 1g | >97% | 5 In Stock | Shenzhen | Inquiry |
| 5g | >97% | 5 In Stock | Shanghai | Inquiry |
| 10g | >97% | 5 In Stock | Shenzhen | Inquiry |
871658-02-5 / 2-azabicyclo[2.1.1]hexane;hydrochloride
Basic Information
CAS
871658-02-5
Multi CAS
No
Molecular Formula
C5H10CLN
Molecular Weight
119.590000
Exact Mass
119.050177
InChI
InChI=1S/C5H9N.ClH/c1-4-2-5(1)6-3-4;/h4-6H,1-3H2;1H
InChIKey
ILHPSPUYHFANIX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
7
Fraction Csp3
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
31.76
TPSA
12.03
LogP / Solubility
WLOGP
0.79
MLOGP
0.69
XLogP3
0.79
Consensus LogP
0.76
Log S (ESOL)
-1.08
Class (ESOL)
Soluble
Log S (Ali)
-1.11
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.09
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)
-2.89
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
Co-MOF-74
- CAS RN: 871658-67-2
- Product Code: starshine_CAS871658-67-2
- Purity/Analytical method: >99.0%
-
-
2-[4-(2-Oxopyrrolidin-1-yl)phenoxy]acetic acid
- CAS RN: 871673-06-2
- Product Code: SSC-196801
-
4-(3-BROMO-PHENYL)-THIAZOLE-2-CARBOXYLIC ACID ETHYL ESTER
- CAS RN: 871673-11-9
- Product Code: SSC-196802
-
3-AMINO-N-CYCLOPROPYLBENZAMIDE
- CAS RN: 871673-24-4
- Product Code: starshine_CAS871673-24-4
- Purity/Analytical method: >99.0%
-
1-(5-AMINO-3-METHYLISOTHIAZOL-4-YL)ETHANONE
- CAS RN: 871673-30-2
- Product Code: starshine_CAS871673-30-2
- Purity/Analytical method: >99.0%
![CAS 871673-06-2 2-[4-(2-Oxopyrrolidin-1-yl)phenoxy]acetic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/871673-06-2.gif)
