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CAS 69843-12-5 3-Fluoro-1-methyl-1H-pyrazole molecular structure lightbox
CAS RN: 69843-12-5

3-Fluoro-1-methyl-1H-pyrazole

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260320 100mg / 250mg / 500mg Out of stock 1 business days Inquiry
  • Product code: SSC-179619
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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 69843-12-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

69843-12-5 / 3-fluoro-1-methylpyrazole

Standard CAS: 69843-12-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
69843-12-5
Multi CAS
No
Molecular Formula
C4FH5N2
Molecular Weight
100.090000
Exact Mass
100.043676
InChI
InChI=1S/C4H5FN2/c1-7-3-2-4(5)6-7/h2-3H,1H3
InChIKey
AYEPFBZMLHFDRM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
7
Aromatic heavy atom count
5
Fraction Csp3
0.25
H-bond acceptors
2
Molar refractivity
23.17
TPSA
17.82

LogP / Solubility

WLOGP
0.56
MLOGP
0.48
XLogP3
0.7
Consensus LogP
0.58
Log S (ESOL)
-1.34
Class (ESOL)
Soluble
Log S (Ali)
-0.78
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.77
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)
-2.93

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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