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CAS 90064-47-4 4-IODO-2,5-DIMETHOXYBENZALDEHYDE molecular structure lightbox
CAS RN: 90064-47-4

4-IODO-2,5-DIMETHOXYBENZALDEHYDE

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251105 10g In stock Shanghai Inquiry
Batchno.20260117 1g In stock Shanghai Inquiry
Batchno.20260505 250mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250312 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-202483
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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: 0.1g, 0.25g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 90064-47-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g >95% 2 In Stock Shanghai Inquiry
0.25g >95% 2 In Stock Shanghai Inquiry
1g >95% 2 In Stock Hong Kong Inquiry
5g >95% 2 In Stock Beijing Inquiry

90064-47-4 / 4-iodo-2,5-dimethoxybenzaldehyde

Standard CAS: 90064-47-4 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
90064-47-4
Multi CAS
No
Molecular Formula
C9H9IO3
Molecular Weight
292.070000
Exact Mass
291.959640
InChI
InChI=1S/C9H9IO3/c1-12-8-4-7(10)9(13-2)3-6(8)5-11/h3-5H,1-2H3
InChIKey
GRXBIKUKMBJWCM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
3
H-bond acceptors
3
Molar refractivity
57.65
TPSA
35.53

LogP / Solubility

WLOGP
2.12
MLOGP
1.88
XLogP3
2
Consensus LogP
2
Log S (ESOL)
-3.13
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.49
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.68
Class (SILICOS-IT)
Poorly 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)
-3

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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