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CAS 172033-73-7 4-FLUORO-1-NAPHTHALDEHYDE molecular structure lightbox
CAS RN: 172033-73-7

4-FLUORO-1-NAPHTHALDEHYDE

Product Availability

Choose a grade to view its available package options.

6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260527 100mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250129 10g In stock Shanghai Inquiry
Batchno.20250314 1g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250712 250mg In stock Shanghai Inquiry
Batchno.20250505 25g In stock Shanghai Inquiry
Batchno.20260127 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-075685
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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: 5g
  • 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 172033-73-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Shanghai Inquiry

172033-73-7 / 4-fluoronaphthalene-1-carbaldehyde

Standard CAS: 172033-73-7 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
172033-73-7
Multi CAS
No
Molecular Formula
C11H7FO
Molecular Weight
174.170000
Exact Mass
174.048093
SMILES
C1=CC=C2C(=C1)C(=CC=C2F)C=O
InChI
InChI=1S/C11H7FO/c12-11-6-5-8(7-13)9-3-1-2-4-10(9)11/h1-7H
InChIKey
LZUCGZVKZDBILP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
10
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
49.29
TPSA
17.07

LogP / Solubility

WLOGP
2.79
MLOGP
2.45
XLogP3
2.7
Consensus LogP
2.65
Log S (ESOL)
-3.18
Class (ESOL)
Poorly soluble
Log S (Ali)
-3
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.23
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.8

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
H319 (97.5%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P264+P265, P280, P305+P351+P338, and P337+P317

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