Bistrifluoroacetamide

CAT: 0127-PC105306-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC105306-01Size:100 mg

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CAS Number

407-24-9

MDL Number

MFCD00013564

Purity

98%

Smiles

C(=O)(C(F)(F)F)NC(=O)C(F)(F)F

Chemical Information

2,2,2-Trifluoro-N-(trifluoroacetyl)acetamide

CAS Number	407-24-9
PubChem CID	67885
IUPAC Name	2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide
Molecular Formula	C4HF6NO2
Molecular Weight	209.05
XLogP	1.6
Topological Polar Surface Area	46.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	0
Heavy Atom Count	13
Formal Charge	0
Complexity	204

SMILES

C(=O)(C(F)(F)F)NC(=O)C(F)(F)F

InChI

InChI=1S/C4HF6NO2/c5-3(6,7)1(12)11-2(13)4(8,9)10/h(H,11,12,13)

InChIKey

GMQVFHZSXKJCIV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 407-24-9

CID: 67885

Formula: C4HF6NO2

MW: 209.05

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	209.05
XLogP3	1.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	0
Exact Mass	208.99114725
Monoisotopic Mass	208.99114725
Topological Polar Surface Area	46.2 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	204
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-252496	Bistrifluoroacetamide