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CAS 1547-87-1 2,2,2-Trifluoro-N,N-dimethylacetamide molecular structure lightbox
CAS RN: 1547-87-1

2,2,2-Trifluoro-N,N-dimethylacetamide

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260130 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260318 5g / 25g / 100g / 500g Confirm by inquiry Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251106 100g In stock Shanghai, Tianjin Inquiry
Batchno.20250411 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250815 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20251101 500g In stock Shanghai, Shenzhen Inquiry
Batchno.20260604 5g In stock Shanghai, Tianjin, Chengdu Inquiry
  • Product code: SSC-064034
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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: ≥98%
  • 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 1547-87-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥98% 0 Out of Stock Shenzhen Inquiry

1547-87-1 / 2,2,2-trifluoro-N,N-dimethylacetamide

Standard CAS: 1547-87-1 Multi CAS: No
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
1547-87-1
Multi CAS
No
Molecular Formula
C4H6F3NO
Molecular Weight
141.090000
Exact Mass
141.040148
SMILES
CN(C)C(=O)C(F)(F)F
InChI
InChI=1S/C4H6F3NO/c1-8(2)3(9)4(5,6)7/h1-2H3
InChIKey
WXBWKMLIVXELSF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.75
H-bond acceptors
1
Molar refractivity
24.75
TPSA
20.31

LogP / Solubility

WLOGP
0.64
MLOGP
0.55
XLogP3
0.8
Consensus LogP
0.66
Log S (ESOL)
-1.12
Class (ESOL)
Soluble
Log S (Ali)
-1.18
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.11
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)
-3.13

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Flammable Irritant
Signal
Warning
GHS Hazard Statements
H226 (66.7%): Flammable liquid and vapor [Warning Flammable liquids] H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501

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