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CAS 122531-09-3 5-bromo-6-chloro-indole molecular structure lightbox
CAS RN: 122531-09-3

5-bromo-6-chloro-indole

Product Availability

Choose a grade to view its available package options.

15 package records14 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250616 100g In stock Inquiry
Batchno.20260324 10g Out of stock Inquiry
Batchno.20250402 1g In stock Inquiry
Batchno.20250708 250mg In stock Inquiry
Batchno.20260220 25g In stock Inquiry
Batchno.20260131 50mg In stock Inquiry
Batchno.20260422 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250515 100g In stock Shanghai Inquiry
Batchno.20250419 10g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20260120 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260109 250mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20251209 25g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20250601 500g In stock Shanghai Inquiry
Batchno.20250814 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251104 1g / 5g / 10g / 25g / 100g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-025480
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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, 5g, 10g, 25g
  • 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 122531-09-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry
5g ≥95% 0 Out of Stock Beijing Inquiry
10g ≥95% 0 Out of Stock Shenzhen Inquiry
25g ≥95% 0 Out of Stock Shenzhen Inquiry

122531-09-3 / 5-bromo-6-chloro-1H-indole

Standard CAS: 122531-09-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
122531-09-3
Multi CAS
No
Molecular Formula
C8H5BrClN
Molecular Weight
230.490000
Exact Mass
228.929390
SMILES
C1=CNC2=CC(=C(C=C21)Br)Cl
InChI
InChI=1S/C8H5BrClN/c9-6-3-5-1-2-11-8(5)4-7(6)10/h1-4,11H
InChIKey
SMZUROGBNBCCPT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
9
H-bond donors
1
Molar refractivity
51.01
TPSA
15.79

LogP / Solubility

WLOGP
3.58
MLOGP
3.16
XLogP3
3.4
Consensus LogP
3.38
Log S (ESOL)
-4.13
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.04
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.13
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.58

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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