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CAS 85272-31-7 Di-tert-butylsilyl Bis(trifluoromethanesulfonate) molecular structure lightbox
CAS RN: 85272-31-7

Di-tert-butylsilyl Bis(trifluoromethanesulfonate)

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260316 100g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20260510 1g In stock Shanghai, Tianjin, Wuhan Inquiry
Batchno.20251230 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251031 500g In stock Shanghai Inquiry
Batchno.20251011 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-193595
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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: ≥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 85272-31-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥97% 0 Out of Stock Shanghai Inquiry

85272-31-7 / [ditert-butyl(trifluoromethylsulfonyloxy)silyl] trifluoromethanesulfonate

Standard CAS: 85272-31-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
85272-31-7
Multi CAS
Yes
Molecular Formula
C10F6H18O6S2Si
Molecular Weight
440.500000
Exact Mass
440.021826
InChI
InChI=1S/C10H18F6O6S2Si/c1-7(2,3)25(8(4,5)6,21-23(17,18)9(11,12)13)22-24(19,20)10(14,15)16/h1-6H3
InChIKey
HUHKPYLEVGCJTG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
25
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
6
Molar refractivity
77.3
TPSA
86.74

LogP / Solubility

WLOGP
3.76
MLOGP
3.34
XLogP3
3.76
Consensus LogP
3.62
Log S (ESOL)
-4.68
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.89
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.12
Class (SILICOS-IT)
Insoluble

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
Yes
Log Kp (skin permeation)
-2.74

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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