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CAS 71902-33-5 3,5-Difluoropyridine molecular structure lightbox
CAS RN: 71902-33-5

3,5-Difluoropyridine

Product Availability

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250417 5g / 25g Confirm by inquiry Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260105 5g In stock Shandong Inquiry
  • Product code: ICTD4038
  • Purity/Analytical Methods: >98.0%(GC)
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71902-33-5 / 3,5-difluoropyridine

Standard CAS: 71902-33-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
71902-33-5
Multi CAS
Yes
Molecular Formula
C5F2H3N
Molecular Weight
115.080000
Exact Mass
115.023355
InChI
InChI=1S/C5H3F2N/c6-4-1-5(7)3-8-2-4/h1-3H
InChIKey
WRXAZPPGFLETFR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
6
H-bond acceptors
1
Molar refractivity
24.15
TPSA
12.89

LogP / Solubility

WLOGP
1.36
MLOGP
1.19
XLogP3
1.1
Consensus LogP
1.22
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-1.49
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.54
Class (SILICOS-IT)
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)
-2.46

Drug-likeness / Medicinal Chemistry

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

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