![CAS 6488-00-2 [2-(3-CHLOROPHENOXY)ETHYL]AMINE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB3356272.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: 1g, 5g, 0.1g, 0.25g, 10g, 25g
- Available purity: ≥95%
- 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 |
|---|---|---|---|---|
| 1g | -- | 5 In Stock | Beijing | Inquiry |
| 1g | ≥95% | 5 In Stock | Shanghai | Inquiry |
| 5g | -- | 3 In Stock | Beijing | Inquiry |
| 5g | ≥95% | 3 In Stock | Beijing | Inquiry |
| 0.1g | -- | 2 In Stock | Beijing | Inquiry |
| 0.1g | ≥95% | 2 In Stock | Beijing | Inquiry |
| 0.25g | -- | 2 In Stock | Shanghai | Inquiry |
| 0.25g | ≥95% | 2 In Stock | Shenzhen | Inquiry |
| 10g | -- | 1 In Stock | Beijing | Inquiry |
| 10g | ≥95% | 1 In Stock | Shanghai | Inquiry |
| 25g | -- | 1 In Stock | Hong Kong | Inquiry |
| 25g | ≥95% | 1 In Stock | Shanghai | Inquiry |
6488-00-2 / 2-(3-chlorophenoxy)ethanamine
Basic Information
CAS
6488-00-2
Multi CAS
Yes
Molecular Formula
C8H10CLNO
Molecular Weight
171.620000
Exact Mass
171.045092
InChI
InChI=1S/C8H10ClNO/c9-7-2-1-3-8(6-7)11-5-4-10/h1-3,6H,4-5,10H2
InChIKey
SKLZUIZCCAYHOB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
1
Molar refractivity
46
TPSA
35.25
LogP / Solubility
WLOGP
1.68
MLOGP
1.47
XLogP3
2
Consensus LogP
1.72
Log S (ESOL)
-2.17
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.18
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.53
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)
-2.58
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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