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CAS 38521-51-6 2,3,4,5,6-PENTABROMOBENZYL BROMIDE molecular structure lightbox
CAS RN: 38521-51-6

2,3,4,5,6-PENTABROMOBENZYL BROMIDE

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250829 100mg / 250mg / 500mg Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-146173
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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: 1g
  • 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 38521-51-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Beijing Inquiry

38521-51-6 / 1,2,3,4,5-pentabromo-6-(bromomethyl)benzene

Standard CAS: 38521-51-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
38521-51-6
Multi CAS
No
Molecular Formula
C7H2BR6
Molecular Weight
565.500000
Exact Mass
565.519530
InChI
InChI=1S/C7H2Br6/c8-1-2-3(9)5(11)7(13)6(12)4(2)10/h1H2
InChIKey
PYOIYKRKAHYOKO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
1
Molar refractivity
77.57
TPSA
0.0000

LogP / Solubility

WLOGP
6.39
MLOGP
5.67
XLogP3
5.9
Consensus LogP
5.99
Log S (ESOL)
-7.65
Class (ESOL)
Insoluble
Log S (Ali)
-8.81
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.76
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.63

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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