![CAS 685-27-8 N-Methylbis(trifluoroacetamide) [Trifluoroacylating Agent] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/m0671-jpgcontextbwfzdgvyfhjvb3r8mzmymjv8aw1hz2uvanblz3xom2yvadnklzg5mzeyote0oty0nzgvtta2nzeuanbnfge5y2zlmjy2mwi2nweznmm5njq4ywqzogm4nzmwywnjnzliymfmywnhywi1ymiwztg4mty0ztyzodi5ytbimte.jpeg)
CAS RN: 685-27-8
N-Methylbis(trifluoroacetamide) [Trifluoroacylating Agent]
Product Availability
Choose a grade to view its available package options.
3 package records0 with current stock1 grade group
- Product code: SSC-178216
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: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
685-27-8 / 2,2,2-trifluoro-N-methyl-N-(2,2,2-trifluoroacetyl)acetamide
Basic Information
CAS
685-27-8
Multi CAS
Yes
Molecular Formula
C5F6H3NO2
Molecular Weight
223.070000
Exact Mass
223.006797
InChI
InChI=1S/C5H3F6NO2/c1-12(2(13)4(6,7)8)3(14)5(9,10)11/h1H3
InChIKey
AWGBWLXGUPTXHF-UHFFFAOYSA-N
Physical Properties
Physical Description
Clear colorless liquid
State
Liquid
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
0.6
H-bond acceptors
2
Molar refractivity
29.89
TPSA
37.38
LogP / Solubility
WLOGP
1.1
MLOGP
0.97
XLogP3
1.7
Consensus LogP
1.26
Log S (ESOL)
-1.91
Class (ESOL)
Soluble
Log S (Ali)
-2.18
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.02
Class (SILICOS-IT)
Moderately 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)
-3.3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
Heptafluorobutyric Anhydride
- CAS RN: 336-59-4
- Product Code: ICTH0337
- Purity/Analytical method: >95.0%(T)
-
-
-
4-Nitro-1,2-phenylenediamine Monohydrochloride [Sensitive reagent for the determination of Se by GC-ECD]
- CAS RN: 53209-19-1
- Product Code: SSC-160417
-
Pentafluorobenzyl p-Toluenesulfonate [Derivatizing Reagent for GC of Inorganic Anions]
- CAS RN: 32974-36-0
- Product Code: SSC-138769
-
O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine Hydrochloride [for Oxime Preparation]
- CAS RN: 57981-02-9
- Product Code: SSC-166178
![CAS 53209-19-1 4-Nitro-1,2-phenylenediamine Monohydrochloride [Sensitive reagent for the determination of Se by GC-ECD] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/a5081-jpgcontextbwfzdgvyfhjvb3r8mjk1mjz8aw1hz2uvanblz3xoytivadk1lzg5mjg1mti5mdexntavqtuwodeuanbnfdm3ymuxmzi2zmqxyjflzjm2mjgwmzk3ywnjzmyyyjblodhhztmwmtkznju4ytljyju4ywnjzju1n2u4mtc0mwe.jpeg)
![CAS 32974-36-0 Pentafluorobenzyl p-Toluenesulfonate [Derivatizing Reagent for GC of Inorganic Anions] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/t1204-jpgcontextbwfzdgvyfhjvb3r8mjkymzn8aw1hz2uvanblz3xonzyvagnklzg5mzi0mjg0oda1ndivvdeymdquanbnfda1otqyzjm0nwrmntzimgzmnzjky2ewyje2mmy4mjdkymvjmjrimdmyzdlizge0zme1nwm0mwrlmzi4ymq2owq.jpeg)
![CAS 57981-02-9 O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine Hydrochloride [for Oxime Preparation] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/p0822-jpgcontextbwfzdgvyfhjvb3r8mzy5ndh8aw1hz2uvanblz3xomdqvade5lzg5mze5ntq3odyzmzqvuda4mjiuanbnfge3mjlinmvhmdzhndy4mjqwowy2mgfmmjrhnjbinjg5zmi3zdi4mzezntblztazzgjlywu0zgq1ywq2mmrjnmi.jpeg)