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CAS 157496-32-7 3-Fluoropyridazine molecular structure lightbox
CAS RN: 157496-32-7

3-Fluoropyridazine

  • Product code: SSC-066429
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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: 0.05g, 0.1g, 0.25g, 1g
  • Available purity: >95%
  • Inventory rows with stock: 4
  • 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 157496-32-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.05g >95% 2 In Stock Shenzhen Inquiry
0.1g >95% 2 In Stock Shanghai Inquiry
0.25g >95% 2 In Stock Shenzhen Inquiry
1g >95% 2 In Stock Hong Kong Inquiry

157496-32-7 / 3-fluoropyridazine

Standard CAS: 157496-32-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
157496-32-7
Multi CAS
No
Molecular Formula
C4H3FN2
Molecular Weight
98.080000
Exact Mass
98.028026
SMILES
C1=CC(=NN=C1)F
InChI
InChI=1S/C4H3FN2/c5-4-2-1-3-6-7-4/h1-3H
InChIKey
JOSLQLBJJDFBCQ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Aromatic heavy atom count
6
H-bond acceptors
2
Molar refractivity
21.99
TPSA
25.78

LogP / Solubility

WLOGP
0.62
MLOGP
0.53
XLogP3
-0.4
Consensus LogP
0.25
Log S (ESOL)
-1.47
Class (ESOL)
Soluble
Log S (Ali)
-0.81
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.81
Class (SILICOS-IT)
Very 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)
-2.88

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)
Irritant
Signal
Warning
GHS Hazard Statements
H227 (100%): Combustible liquid [Warning Flammable liquids] H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501

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