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CAS 2040-83-7 2,4-Dichloro-6-iodophenol molecular structure lightbox
CAS RN: 2040-83-7

2,4-Dichloro-6-iodophenol

Product Availability

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7 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250416 100g In stock Shanghai Inquiry
Batchno.20250502 100mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250329 100mg / 250mg / 1g / 5g / 25g Out of stock 8-10 business days Inquiry
Batchno.20260205 1g In stock Shanghai Inquiry
Batchno.20260701 250mg In stock Shanghai, Chengdu Inquiry
Batchno.20260405 25g In stock Shanghai Inquiry
Batchno.20260408 5g In stock Shanghai Inquiry
  • Product code: SSC-095995
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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: 5g
  • 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 2040-83-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

2040-83-7 / 2,4-dichloro-6-iodophenol

Standard CAS: 2040-83-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
2040-83-7
Multi CAS
No
Molecular Formula
C6H3Cl2IO
Molecular Weight
288.890000
Exact Mass
287.860570
SMILES
C1=C(C=C(C(=C1Cl)O)I)Cl
InChI
InChI=1S/C6H3Cl2IO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H
InChIKey
UMDKVOOEGYNMEB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Aromatic heavy atom count
6
H-bond acceptors
1
H-bond donors
1
Molar refractivity
50.84
TPSA
20.23

LogP / Solubility

WLOGP
3.3
MLOGP
2.92
XLogP3
3.3
Consensus LogP
3.17
Log S (ESOL)
-4.16
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.31
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.28
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)
-2.14

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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