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CAS 1060802-49-4 5-Fluoropyridine-3-Sulfonyl Chloride molecular structure lightbox
CAS RN: 1060802-49-4

5-Fluoropyridine-3-Sulfonyl Chloride

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260621 250mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-007746
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1060802-49-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

1060802-49-4 / 5-fluoropyridine-3-sulfonyl chloride

5-fluoropyridine-3-sulfonyl chloride | RefChem:535998 | 821-222-1

Standard CAS: 1060802-49-4 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1060802-49-4
Multi CAS
No
Molecular Formula
C5H3ClFNO2S
Molecular Weight
195.600000
Exact Mass
194.955705
SMILES
C1=C(C=NC=C1S(=O)(=O)Cl)F
InChI
InChI=1S/C5H3ClFNO2S/c6-11(9,10)5-1-4(7)2-8-3-5/h1-3H
InChIKey
FSAMEVYXVKKALC-UHFFFAOYSA-N
Synonyms
5-fluoropyridine-3-sulfonyl chloride RefChem:535998 821-222-1 5-Fluoro-pyridine-3-sulfonyl chloride MFCD13189070

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
Molar refractivity
37.23
TPSA
47.03

LogP / Solubility

WLOGP
1.15
MLOGP
1.01
XLogP3
1
Consensus LogP
1.05
Log S (ESOL)
-2.11
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.99
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2
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)
-3.1

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Corrosive
Signal
Danger
GHS Hazard Statements
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement Codes
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501

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