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CAS 37891-79-5 Bis(methylthio)(trimethylsilyl)methane molecular structure lightbox
CAS RN: 37891-79-5

Bis(methylthio)(trimethylsilyl)methane

  • Product code: SSC-145331
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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: ≥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 37891-79-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

37891-79-5 / bis(methylsulfanyl)methyl-trimethylsilane

Standard CAS: 37891-79-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
37891-79-5
Multi CAS
No
Molecular Formula
C6H16S2Si
Molecular Weight
180.400000
Exact Mass
180.046269
InChI
InChI=1S/C6H16S2Si/c1-7-6(8-2)9(3,4)5/h6H,1-5H3
InChIKey
QEPMPXAUMUWNNO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
54.16
TPSA
50.6000

LogP / Solubility

WLOGP
2.92
MLOGP
2.56
XLogP3
2.92
Consensus LogP
2.8
Log S (ESOL)
-2.6
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.14
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.61
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)
-1.75

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

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