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CAS 796851-05-3 3-Chloro-2-fluoro-4-iodopyridine molecular structure lightbox
CAS RN: 796851-05-3

3-Chloro-2-fluoro-4-iodopyridine

  • Product code: SSC-188786
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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
  • Available purity: ≥95%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 796851-05-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 1 In Stock Shenzhen Inquiry
5g ≥95% 1 In Stock Hong Kong Inquiry

796851-05-3 / 3-chloro-2-fluoro-4-iodopyridine

Standard CAS: 796851-05-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
796851-05-3
Multi CAS
No
Molecular Formula
C5H2CLFIN
Molecular Weight
257.430000
Exact Mass
256.890450
InChI
InChI=1S/C5H2ClFIN/c6-4-3(8)1-2-9-5(4)7/h1-2H
InChIKey
NPDICENVXROWJV-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
1
Molar refractivity
41.92
TPSA
12.89

LogP / Solubility

WLOGP
2.48
MLOGP
2.19
XLogP3
2.6
Consensus LogP
2.42
Log S (ESOL)
-3.49
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.46
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.39
Class (SILICOS-IT)
Poorly 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)
-2.53

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

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