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CAS 459-46-1 4-Fluorobenzyl Bromide molecular structure lightbox
CAS RN: 459-46-1

4-Fluorobenzyl Bromide

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260424 100g In stock Shanghai, Shandong, Guangdong Inquiry
Batchno.20250518 2.5kg In stock Shandong Inquiry
Batchno.20260303 25g In stock Shanghai, Shandong, Guangdong, Hebei Inquiry
Batchno.20250721 500g In stock Shanghai, Shandong Inquiry
Batchno.20250923 5g In stock Shanghai, Shandong, Chongqing, Hebei Inquiry
  • Product code: SSC-153500
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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, 25g, 100g, 500g
  • 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 459-46-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g >97% 0 Out of Stock Hong Kong Inquiry
25g >97% 0 Out of Stock Shanghai Inquiry
100g >97% 0 Out of Stock Beijing Inquiry
500g >97% 0 Out of Stock Shanghai Inquiry

459-46-1 / 1-(bromomethyl)-4-fluorobenzene

Standard CAS: 459-46-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
459-46-1
Multi CAS
Yes
Molecular Formula
BC7H6Rf
Molecular Weight
189.020000
Exact Mass
187.963690
InChI
InChI=1S/C7H6BrF/c8-5-6-1-3-7(9)4-2-6/h1-4H,5H2
InChIKey
NVNPLEPBDPJYRZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
39.03
TPSA
0.0000

LogP / Solubility

WLOGP
2.72
MLOGP
2.39
XLogP3
2.8
Consensus LogP
2.64
Log S (ESOL)
-3.15
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.07
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.27
Class (SILICOS-IT)
Poorly 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)
-1.94

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

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