CAS RN: 35453-19-1
5-Amino-2,4,6-triiodoisophthalic Acid
Product Availability
Choose a grade to view its available package options.
10 package records10 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260328 | 100g | In stock | Shanghai, Shandong, Guangdong | Inquiry |
| Batchno.20250122 | 100g | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20260122 | 10g | In stock | Shanghai, Chengdu | Inquiry |
| Batchno.20260303 | 1kg | In stock | Shanghai | Inquiry |
| Batchno.20250704 | 25g | In stock | Shanghai | Inquiry |
| Batchno.20260624 | 25g | In stock | Shanghai, Shenzhen | Inquiry |
| Batchno.20250115 | 500g | In stock | Shanghai, Shandong | Inquiry |
| Batchno.20250420 | 500g | In stock | Shanghai, Tianjin, Chengdu | Inquiry |
| Batchno.20250417 | 5g | In stock | Shanghai, Chongqing | Inquiry |
| Batchno.20250617 | 5g | In stock | Shanghai, Tianjin | Inquiry |
- Product code: SSC-142456
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: 100g
- Available purity: ＞97%
- 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 |
|---|---|---|---|---|
| 100g | ＞97% | 0 Out of Stock | Shenzhen | Inquiry |
35453-19-1 / 5-amino-2,4,6-triiodobenzene-1,3-dicarboxylic acid
Basic Information
CAS
35453-19-1
Multi CAS
Yes
Molecular Formula
C8H4I3NO4
Molecular Weight
558.830000
Exact Mass
558.727500
InChI
InChI=1S/C8H4I3NO4/c9-3-1(7(13)14)4(10)6(12)5(11)2(3)8(15)16/h12H2,(H,13,14)(H,15,16)
InChIKey
JEZJSNULLBSYHV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
6
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
3
Molar refractivity
82.92
TPSA
100.62
LogP / Solubility
WLOGP
2.48
MLOGP
2.22
XLogP3
2.2
Consensus LogP
2.3
Log S (ESOL)
-5.01
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.93
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.59
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.37
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
