2-Amino-N-(2,2,2-trifluoroethyl)acetamide

C₄H₇F₃N₂OCAS 359821-38-8156.11 g/mol

Open in Covalent MOL file

Alkyl halide Amide Primary amine

Properties

Molecular formula: C₄H₇F₃N₂O
Molar mass: 156.11 g/mol
Exact mass: 156.0510 Da
logP: -0.38Crippen estimate
Polar surface area: 55.1 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

359821-38-8

SMILES

C(C(=O)NCC(F)(F)F)N

InChIKey

ACUOJJBRHCFOKT-UHFFFAOYSA-N

InChI

InChI=1S/C4H7F3N2O/c5-4(6,7)2-9-3(10)1-8/h1-2,8H2,(H,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2-Amino-N-(2,2,2-trifluoroethyl)acetamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-Amino-N-(2,2,2-trifluoroethyl)acetamide hydrochloride1171331-39-7Salt

Similar compounds

Tetraglycine637-84-341 % similar H-Gly-nhme hcl49755-94-439 % similar (2,2,2-Trifluoroethyl)hydrazine5042-30-836 % similar 2,2,2-Trifluoro-N-(2,2,2-trifluoroethyl)ethanamine407-01-235 % similar Glycyl-glycyl-valine20274-89-933 % similar Glycyl-D-asparagine24667-21-833 % similar Glycylglycyl-L-leucine14857-82-032 % similar 5,5-Dimethylpiperidine-2,4-dione118263-81-331 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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