CAS RN: 5969-83-5
2-(4-chlorophenyl)pyridine
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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, 0.25g, 5g
- Available purity: ≥95%
- Inventory rows with stock: 2
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 5969-83-5
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 1g |
≥95% |
3
In Stock
|
Shenzhen |
Inquiry |
| 0.25g |
≥95% |
1
In Stock
|
Hong Kong |
Inquiry |
| 5g |
≥95% |
0
Out of Stock
|
Hong Kong |
Inquiry |
5969-83-5 / 2-(4-chlorophenyl)pyridine
Standard CAS: 5969-83-5
Multi CAS: Yes
Basic Information
CAS
5969-83-5
Multi CAS
Yes
Molecular Formula
C11H8CLN
Molecular Weight
189.640000
Exact Mass
189.034527
InChI
InChI=1S/C11H8ClN/c12-10-6-4-9(5-7-10)11-3-1-2-8-13-11/h1-8H
InChIKey
WHXIEVDMCNQVOV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
12
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
54.68
TPSA
12.89
LogP / Solubility
WLOGP
3.4
MLOGP
2.99
XLogP3
3.3
Consensus LogP
3.23
Log S (ESOL)
-3.78
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.57
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.84
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.46
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5