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CAS 50590-07-3 4-IODO-3-NITROPHENOL molecular structure lightbox
CAS RN: 50590-07-3

4-IODO-3-NITROPHENOL

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251107 10g In stock Shanghai Inquiry
Batchno.20250704 1g In stock Shanghai, Tianjin Inquiry
Batchno.20260127 250mg In stock Shanghai Inquiry
Batchno.20250111 25g In stock Shanghai Inquiry
Batchno.20260529 5g In stock Shanghai Inquiry
  • Product code: SSC-157163
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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: 0.25g, 1g, 5g, 10g
  • Available purity: ≥97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 50590-07-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g ≥97% 0 Out of Stock Shenzhen Inquiry
1g ≥97% 0 Out of Stock Hong Kong Inquiry
5g ≥97% 0 Out of Stock Shenzhen Inquiry
10g ≥97% 0 Out of Stock Hong Kong Inquiry

50590-07-3 / 4-iodo-3-nitrophenol

Standard CAS: 50590-07-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
50590-07-3
Multi CAS
Yes
Molecular Formula
C6H4InO3
Molecular Weight
265.010000
Exact Mass
264.923590
InChI
InChI=1S/C6H4INO3/c7-5-3-4(9)1-2-6(5)8(10)11/h1-3,9H
InChIKey
FIWCMSJAIDKMNX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
47.48
TPSA
63.37

LogP / Solubility

WLOGP
1.9
MLOGP
1.68
XLogP3
2
Consensus LogP
1.86
Log S (ESOL)
-3.02
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.11
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.08
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)
-2.98

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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