CAS RN: 811842-30-5
2-BROMO-1-FLUORO-4-IODOBENZENE
Product Availability
Choose a grade to view its available package options.
10 package records8 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260323 | 100g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20250113 | 10g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry |
| Batchno.20260510 | 1kg | Out of stock | Inquiry | |
| Batchno.20250417 | 25g | In stock | Shenzhen, Tianjin, Wuhan | Inquiry |
| Batchno.20260203 | 500g | In stock | Shenzhen, Tianjin | Inquiry |
| Batchno.20260310 | 5g | In stock | Shenzhen, Tianjin | Inquiry |
- Product code: SSC-189732
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, 10g, 25g, 100g
- Available purity: >98%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
811842-30-5 / 2-bromo-1-fluoro-4-iodobenzene
Basic Information
CAS
811842-30-5
Multi CAS
No
Molecular Formula
BC6H3IRf
Molecular Weight
300.890000
Exact Mass
299.844690
InChI
InChI=1S/C6H3BrFI/c7-5-3-4(9)1-2-6(5)8/h1-3H
InChIKey
LHRMBQARSBULRX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
6
H-bond acceptors
1
Molar refractivity
46.82
TPSA
0.0000
LogP / Solubility
WLOGP
3.19
MLOGP
2.82
XLogP3
3.4
Consensus LogP
3.14
Log S (ESOL)
-4.21
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.33
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.27
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.29
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
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