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CAS 97-18-7 2,2′-Thiobis(4,6-dichlorophenol) molecular structure lightbox
CAS RN: 97-18-7

2,2′-Thiobis(4,6-dichlorophenol)

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250914 100g In stock Shanghai Inquiry
Batchno.20251120 1g In stock Shanghai, Shenzhen, Wuhan Inquiry
Batchno.20251205 250mg In stock Shanghai, Wuhan Inquiry
Batchno.20250322 25g In stock Shanghai Inquiry
Batchno.20251005 5g In stock Shanghai, Wuhan Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251107 100g In stock Inquiry
Batchno.20260423 25g In stock Inquiry
  • Product code: SSC-212163
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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: 25g
  • Available purity: ≥95%
  • 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 97-18-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥95% 0 Out of Stock Beijing Inquiry

97-18-7 / 2,4-dichloro-6-(3,5-dichloro-2-hydroxyphenyl)sulfanylphenol

Standard CAS: 97-18-7 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
97-18-7
Multi CAS
Yes
Molecular Formula
C12H6CL4O2S
Molecular Weight
356.000000
Exact Mass
355.881311
InChI
InChI=1S/C12H6Cl4O2S/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18/h1-4,17-18H
InChIKey
JFIOVJDNOJYLKP-UHFFFAOYSA-N

Physical Properties

Melting Point
365.9 to 367.7 °F (NTP, 1992) 188 °C
Density
1.73 (NTP, 1992) - Denser than water; will sink 1.73 at 25 °C/4 °C
Physical Description
2,2'-thiobis(4,6-dichlorophenol) appears as white or grayish white crystalline powder with a very faint aromatic or phenolic odor. (NTP, 1992) White or grayish-white, crystalline powder; [HSDB]
Appearance
White or grayish-white, crystalline powder
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
12
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
80.38
TPSA
40.46

LogP / Solubility

WLOGP
5.86
MLOGP
5.18
XLogP3
5.8
Consensus LogP
5.61
Log S (ESOL)
-6.08
Class (ESOL)
Insoluble
Log S (Ali)
-6.71
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.08
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.73

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

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