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CAS 160969-03-9 2-[2-(2,2,2-Trifluoroethoxy)phenoxy]ethyl Methanesulfonate molecular structure lightbox
CAS RN: 160969-03-9

2-[2-(2,2,2-Trifluoroethoxy)phenoxy]ethyl Methanesulfonate

Product Availability

Choose a grade to view its available package options.

7 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260224 100g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250731 10g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250708 1g In stock Shanghai, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251010 1g / 5g Confirm by inquiry Shanghai Inquiry
Batchno.20250124 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250519 500g Out of stock Inquiry
Batchno.20260312 5g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-068738
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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 160969-03-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shanghai Inquiry

160969-03-9 / 2-[2-(2,2,2-trifluoroethoxy)phenoxy]ethyl methanesulfonate

Standard CAS: 160969-03-9 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
160969-03-9
Multi CAS
No
Molecular Formula
C11H13F3O5S
Molecular Weight
314.280000
Exact Mass
314.043579
SMILES
CS(=O)(=O)OCCOC1=CC=CC=C1OCC(F)(F)F
InChI
InChI=1S/C11H13F3O5S/c1-20(15,16)19-7-6-17-9-4-2-3-5-10(9)18-8-11(12,13)14/h2-5H,6-8H2,1H3
InChIKey
HOJMCBMXHWZNKX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
7
H-bond acceptors
5
Molar refractivity
64.28
TPSA
61.83

LogP / Solubility

WLOGP
1.98
MLOGP
1.76
XLogP3
2
Consensus LogP
1.91
Log S (ESOL)
-2.8
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.57
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.19
Class (SILICOS-IT)
Slightly 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)
-3.23

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, 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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