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CAS 29682-44-8 1-BROMO-2,4,5-TRICHLOROBENZENE molecular structure lightbox
CAS RN: 29682-44-8

1-BROMO-2,4,5-TRICHLOROBENZENE

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260317 100g Out of stock 5-7 business days Inquiry
Batchno.20250209 25g In stock Shanghai, Shandong Inquiry
Batchno.20250424 5g In stock Shandong Inquiry
  • Product code: SSC-132769
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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: 25g
  • 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 29682-44-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Shanghai Inquiry

29682-44-8 / 1-bromo-2,4,5-trichlorobenzene

Standard CAS: 29682-44-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
29682-44-8
Multi CAS
No
Molecular Formula
C6H2BRCL3
Molecular Weight
260.300000
Exact Mass
257.840550
InChI
InChI=1S/C6H2BrCl3/c7-3-1-5(9)6(10)2-4(3)8/h1-2H
InChIKey
PHDKZIIWDGIUCG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
Molar refractivity
49.17
TPSA
0.0000

LogP / Solubility

WLOGP
4.41
MLOGP
3.89
XLogP3
4.5
Consensus LogP
4.27
Log S (ESOL)
-4.68
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.88
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.01
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.18

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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