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CAS 13411-42-2 2-Trimethylsilyl-1,3-dithiane molecular structure lightbox
CAS RN: 13411-42-2

2-Trimethylsilyl-1,3-dithiane

Product Availability

Choose a grade to view its available package options.

10 package records9 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260416 1g In stock Inquiry
Batchno.20260429 250mg In stock Inquiry
Batchno.20250606 25g In stock Inquiry
Batchno.20250223 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250302 1g / 5g Confirm by inquiry Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250527 100g Out of stock Inquiry
Batchno.20260325 10g In stock Shanghai, Tianjin Inquiry
Batchno.20260603 1g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250316 25g In stock Shanghai, Tianjin Inquiry
Batchno.20250225 5g In stock Shanghai, Tianjin, Chengdu Inquiry
  • Product code: SSC-041428
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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: 1g
  • Available purity: ≥96%
  • 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 13411-42-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥96% 0 Out of Stock Shanghai Inquiry

13411-42-2 / 1,3-dithian-2-yl(trimethyl)silane

Standard CAS: 13411-42-2 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
13411-42-2
Multi CAS
No
Molecular Formula
C7H16S2Si
Molecular Weight
192.400000
Exact Mass
192.046269
SMILES
C[Si](C)(C)C1SCCCS1
InChI
InChI=1S/C7H16S2Si/c1-10(2,3)7-8-5-4-6-9-7/h7H,4-6H2,1-3H3
InChIKey
BTTUMVHWIAXYPJ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
10
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
56.67
TPSA
50.6000

LogP / Solubility

WLOGP
3.06
MLOGP
2.69
XLogP3
3.06
Consensus LogP
2.94
Log S (ESOL)
-2.89
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.35
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.57
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)
-1.72

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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