CAS RN: 2401-21-0
1,2-Dichloro-3-iodobenzene
Product Availability
Choose a grade to view its available package options.
6 package records6 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251206 | 100g | In stock | Shanghai, Shenzhen, Tianjin | Inquiry |
| Batchno.20250804 | 10g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20251106 | 1g | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20250811 | 25g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250602 | 500g | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20251223 | 5g | In stock | Shanghai, Shenzhen, Tianjin, Wuhan | Inquiry |
- Product code: SSC-117012
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 5g, 10g, 100g, 25g
- Available purity: ≥98%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
2401-21-0 / 1,2-dichloro-3-iodobenzene
Basic Information
CAS
2401-21-0
Multi CAS
No
Molecular Formula
C6H3Cl2I
Molecular Weight
272.890000
Exact Mass
271.865650
SMILES
C1=CC(=C(C(=C1)I)Cl)Cl
InChI
InChI=1S/C6H3Cl2I/c7-4-2-1-3-5(9)6(4)8/h1-3H
InChIKey
VGJKBWPZBVBXGI-UHFFFAOYSA-N
Physical Properties
Physical Description
Light yellow crystalline solid; mp = 35-36 deg C
State
Solid
Computed Properties
Structural Parameters
Heavy atom count
9
Aromatic heavy atom count
6
Molar refractivity
49.18
TPSA
0.0000
LogP / Solubility
WLOGP
3.6
MLOGP
3.17
XLogP3
3.8
Consensus LogP
3.52
Log S (ESOL)
-4.29
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.4
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.42
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)
-1.83
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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