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CAS 74483-45-7 4-(TRIFLUOROMETHYLTHIO)BENZYL CHLORIDE molecular structure lightbox
CAS RN: 74483-45-7

4-(TRIFLUOROMETHYLTHIO)BENZYL CHLORIDE

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260529 1g In stock Shanghai Inquiry
Batchno.20250530 25g In stock Shanghai Inquiry
Batchno.20250718 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: SSC-183940
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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 74483-45-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

74483-45-7 / 1-(chloromethyl)-4-(trifluoromethylsulfanyl)benzene

Standard CAS: 74483-45-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
74483-45-7
Multi CAS
No
Molecular Formula
C8H6CLF3S
Molecular Weight
226.650000
Exact Mass
225.983084
InChI
InChI=1S/C8H6ClF3S/c9-5-6-1-3-7(4-2-6)13-8(10,11)12/h1-4H,5H2
InChIKey
BEWDYNRVCARDOP-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.25
Rotatable bonds
2
H-bond acceptors
1
Molar refractivity
47.91
TPSA
25.3000

LogP / Solubility

WLOGP
4.04
MLOGP
3.56
XLogP3
4
Consensus LogP
3.87
Log S (ESOL)
-4
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.33
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.72
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.24

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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