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CAS 1233205-73-6 2-Ethynyl-6-fluoropyridine molecular structure lightbox
CAS RN: 1233205-73-6

2-Ethynyl-6-fluoropyridine

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251116 10g In stock Shanghai Inquiry
Batchno.20260615 1g In stock Shanghai Inquiry
Batchno.20251019 250mg In stock Shanghai Inquiry
Batchno.20260303 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
Batchno.20260508 5g In stock Shanghai Inquiry
  • Product code: SSC-026972
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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: 0.25g
  • Available purity: ＞97%
  • 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 1233205-73-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ＞97% 0 Out of Stock Shanghai Inquiry

1233205-73-6 / 2-ethynyl-6-fluoropyridine

Standard CAS: 1233205-73-6 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1233205-73-6
Multi CAS
No
Molecular Formula
C7H4FN
Molecular Weight
121.110000
Exact Mass
121.032777
SMILES
C#CC1=NC(=CC=C1)F
InChI
InChI=1S/C7H4FN/c1-2-6-4-3-5-7(8)9-6/h1,3-5H
InChIKey
JFEWFXHNPSMINO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
32.13
TPSA
12.89

LogP / Solubility

WLOGP
1.2
MLOGP
1.05
XLogP3
1.6
Consensus LogP
1.28
Log S (ESOL)
-1.84
Class (ESOL)
Soluble
Log S (Ali)
-1.42
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.44
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)
-2.61

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
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] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501

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