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CAS 406-95-1 2,2,2-TRIFLUOROETHYL ACETATE molecular structure lightbox
CAS RN: 406-95-1

2,2,2-TRIFLUOROETHYL ACETATE

Product Availability

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7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260330 1g / 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Guangdong Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251017 100g In stock Shanghai Inquiry
Batchno.20260313 10g In stock Shanghai Inquiry
Batchno.20250618 1kg In stock Shanghai Inquiry
Batchno.20260331 25g In stock Shanghai Inquiry
Batchno.20250204 500g In stock Shanghai Inquiry
Batchno.20260113 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
  • Product code: SSC-148869
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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 406-95-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ＞97% 0 Out of Stock Hong Kong Inquiry

406-95-1 / 2,2,2-trifluoroethyl acetate

Standard CAS: 406-95-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
406-95-1
Multi CAS
Yes
Molecular Formula
C4F3H5O2
Molecular Weight
142.080000
Exact Mass
142.024164
InChI
InChI=1S/C4H5F3O2/c1-3(8)9-2-4(5,6)7/h2H2,1H3
InChIKey
ZOWSJJBOQDKOHI-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.75
Rotatable bonds
1
H-bond acceptors
2
Molar refractivity
22.69
TPSA
26.3

LogP / Solubility

WLOGP
1.11
MLOGP
0.97
XLogP3
1.2
Consensus LogP
1.09
Log S (ESOL)
-1.36
Class (ESOL)
Soluble
Log S (Ali)
-1.53
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.63
Class (SILICOS-IT)
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)
-2.8

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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