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CAS 56159-89-8 2′,6′-Difluorophenacyl bromide molecular structure lightbox
CAS RN: 56159-89-8

2′,6′-Difluorophenacyl bromide

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250925 1g In stock Inquiry
Batchno.20250306 250mg In stock Inquiry
Batchno.20251222 250mg / 1g / 5g / 10g / 25g Confirm by inquiry Shanghai 5-7 business days Inquiry
Batchno.20260405 25g In stock Inquiry
Batchno.20260108 5g In stock Inquiry
  • Product code: SSC-164136
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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 56159-89-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Hong Kong Inquiry

56159-89-8 / 2-bromo-1-(2,6-difluorophenyl)ethanone

Standard CAS: 56159-89-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
56159-89-8
Multi CAS
No
Molecular Formula
BC8H5ORf2
Molecular Weight
235.020000
Exact Mass
233.949180
InChI
InChI=1S/C8H5BrF2O/c9-4-7(12)8-5(10)2-1-3-6(8)11/h1-3H,4H2
InChIKey
UZKLFNHMBFDXEN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
44.48
TPSA
17.07

LogP / Solubility

WLOGP
2.54
MLOGP
2.24
XLogP3
2.6
Consensus LogP
2.46
Log S (ESOL)
-3.14
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.32
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.54
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)
-2.35

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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