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CAS 1143502-70-8 3-bromo-4,5-difluorobenzaldehyde molecular structure lightbox
CAS RN: 1143502-70-8

3-bromo-4,5-difluorobenzaldehyde

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250701 100mg In stock Shanghai Inquiry
Batchno.20250619 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai Inquiry
Batchno.20260416 1g In stock Shanghai Inquiry
Batchno.20250224 250mg In stock Shanghai Inquiry
Batchno.20250816 5g In stock Shanghai Inquiry
  • Product code: SSC-014172
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 5g, 10g, 1g, 0.1g, 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1143502-70-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 2 In Stock Beijing Inquiry
10g ≥95% 2 In Stock Shanghai Inquiry
1g ≥95% 1 In Stock Shanghai Inquiry
0.1g ≥95% 0 Out of Stock Shanghai Inquiry
0.25g ≥95% 0 Out of Stock Shenzhen Inquiry

1143502-70-8 / 3-bromo-4,5-difluorobenzaldehyde

3-Bromo-4,5-difluorobenzaldehyde | MFCD22056748 | Benzaldehyde, 3-bromo-4,5-difluoro-

Standard CAS: 1143502-70-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1143502-70-8
Multi CAS
No
Molecular Formula
C7H3BrF2O
Molecular Weight
221.000000
Exact Mass
219.933530
SMILES
C1=C(C=C(C(=C1F)F)Br)C=O
InChI
InChI=1S/C7H3BrF2O/c8-5-1-4(3-11)2-6(9)7(5)10/h1-3H
InChIKey
VQSVSYGPVVEMIN-UHFFFAOYSA-N
Synonyms
3-Bromo-4,5-difluorobenzaldehyde MFCD22056748 Benzaldehyde, 3-bromo-4,5-difluoro- 3-Bromo-4,5-difluoro-benzaldehyde SCHEMBL19748916

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
39.45
TPSA
17.07

LogP / Solubility

WLOGP
2.54
MLOGP
2.24
XLogP3
2.3
Consensus LogP
2.36
Log S (ESOL)
-3.15
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.21
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.32
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)
-2.26

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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