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CAS 27126-76-7 [Hydroxy(tosyloxy)iodo]benzene molecular structure lightbox
CAS RN: 27126-76-7

[Hydroxy(tosyloxy)iodo]benzene

Product Availability

Choose a grade to view its available package options.

6 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250120 100g In stock Inquiry
Batchno.20250830 10g Out of stock Inquiry
Batchno.20260506 25g In stock Inquiry
Batchno.20250214 500g Out of stock Inquiry
Batchno.20250201 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260329 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Hebei, Shandong Inquiry
  • Product code: SSC-125927
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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: 1g, 5g, 10g, 25g, 100g, 500g
  • Available purity: >97%
  • 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 27126-76-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >97% 5 In Stock Shanghai Inquiry
5g >97% 4 In Stock Shenzhen Inquiry
10g >97% 1 In Stock Shenzhen Inquiry
25g >97% 1 In Stock Beijing Inquiry
100g >97% 0 Out of Stock Hong Kong Inquiry
500g >97% 0 Out of Stock Shenzhen Inquiry

27126-76-7 / [hydroxy(phenyl)-lambda3-iodanyl] 4-methylbenzenesulfonate

Standard CAS: 27126-76-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
27126-76-7
Multi CAS
Yes
Molecular Formula
C13H13IO4S
Molecular Weight
392.210000
Exact Mass
391.957930
InChI
InChI=1S/C13H13IO4S/c1-11-7-9-13(10-8-11)19(16,17)18-14(15)12-5-3-2-4-6-12/h2-10,15H,1H3
InChIKey
LRIUKPUCKCECPT-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.08
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
1
Molar refractivity
80.83
TPSA
63.6

LogP / Solubility

WLOGP
2.9
MLOGP
2.57
XLogP3
3.7
Consensus LogP
3.06
Log S (ESOL)
-4.3
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.87
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.1
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.05

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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