CAS RN: 1097871-23-2
4-Chloro-2,5-difluoroiodobenzene
Product Availability
Choose a grade to view its available package options.
5 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250614 | 10g | In stock | Shanghai | Inquiry |
| Batchno.20250504 | 1g | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
| Batchno.20260320 | 250mg | In stock | Shanghai, Shenzhen, Wuhan, Chengdu | Inquiry |
| Batchno.20260330 | 25g | In stock | Shanghai, Chengdu | Inquiry |
| Batchno.20260611 | 5g | In stock | Shanghai, Wuhan | Inquiry |
- Product code: SSC-011107
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
- Available purity: ≥95%
- 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.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Beijing | Inquiry |
1097871-23-2 / 1-chloro-2,5-difluoro-4-iodobenzene
1-chloro-2,5-difluoro-4-iodobenzene | 4-Chloro-2,5-difluoroiodobenzene | MFCD18379746
Basic Information
CAS
1097871-23-2
Multi CAS
No
Molecular Formula
C6H2ClF2I
Molecular Weight
274.430000
Exact Mass
273.885780
SMILES
C1=C(C(=CC(=C1Cl)F)I)F
InChI
InChI=1S/C6H2ClF2I/c7-3-1-5(9)6(10)2-4(3)8/h1-2H
InChIKey
JPIRZHIXWRVIAX-UHFFFAOYSA-N
Synonyms
1-chloro-2,5-difluoro-4-iodobenzene
4-Chloro-2,5-difluoroiodobenzene
MFCD18379746
SCHEMBL926241
SCHEMBL30525059
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
6
H-bond acceptors
2
Molar refractivity
44.09
TPSA
0.0000
LogP / Solubility
WLOGP
3.22
MLOGP
2.84
XLogP3
3.4
Consensus LogP
3.15
Log S (ESOL)
-4.02
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.14
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.12
Class (SILICOS-IT)
Slightly 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)
-2.11
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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