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CAS 433939-28-7 1-Bromo-3-(difluoromethoxy)-5-fluorobenzene molecular structure lightbox
CAS RN: 433939-28-7

1-Bromo-3-(difluoromethoxy)-5-fluorobenzene

Product Availability

Choose a grade to view its available package options.

5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250826 100mg In stock Shanghai Inquiry
Batchno.20250515 10g Out of stock Inquiry
Batchno.20251102 1g In stock Shanghai Inquiry
Batchno.20250927 250mg In stock Shanghai Inquiry
Batchno.20250531 5g In stock Shanghai Inquiry
  • Product code: SSC-151639
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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: ≥95%
  • 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 433939-28-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 0 Out of Stock Hong Kong Inquiry

433939-28-7 / 1-bromo-3-(difluoromethoxy)-5-fluorobenzene

Standard CAS: 433939-28-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
433939-28-7
Multi CAS
No
Molecular Formula
BC7H4ORf3
Molecular Weight
241.000000
Exact Mass
239.939760
InChI
InChI=1S/C7H4BrF3O/c8-4-1-5(9)3-6(2-4)12-7(10)11/h1-3,7H
InChIKey
TVMFSEYOFZQZAB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
40.73
TPSA
9.23

LogP / Solubility

WLOGP
3.19
MLOGP
2.81
XLogP3
3.6
Consensus LogP
3.2
Log S (ESOL)
-3.58
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.84
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.11
Class (SILICOS-IT)
Slightly 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)
-1.93

Drug-likeness / Medicinal Chemistry

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

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