2-Amino-N-(2,2,2-trifluoroethyl)acetamide hydrochloride (1:1)

HCID 42913698

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Basic information

CAS: 1171331-39-7
Standard SMILES: Cl.NCC(=O)NCC(F)(F)F
InChIKey: DBNFKWRZLGVLSH-UHFFFAOYSA-N
Molecular formula: C4H8ClF3N2O
Average molar mass: 192.57 g/mol

Names & identifiers

Preferred name: 2-Amino-N-(2,2,2-trifluoroethyl)acetamide hydrochloride (1:1)
IUPAC: 2-amino-N-(2,2,2-trifluoroethyl)acetamide;hydrochloride
English name: 2-AMino-N-(2,2,2-trifluoroethyl)acetaMide hydrochloride
Molecular formula: C4H8ClF3N2O
Molecular weight: 192.57

Names & synonyms

1171331-39-7Acetamide, 2-amino-N-(2,2,2-trifluoroethyl)-, hydrochloride (1:1)2-Amino-N-(2,2,2-trifluoroethyl)acetamide hydrochloride (1:1)EC 806-518-0RefChem:464938806-518-02-amino-N-(2,2,2-trifluoroethyl)acetamide hydrochloride2-amino-N-(2,2,2-trifluoroethyl)acetamide;hydrochlorideC4H8ClF3N2OMFCD121970702-Amino-N-(2,2,2-trifluoroethyl)acetamide HClFluralaner Impurity 5

Show more names

2-Amino-N-(2,2,2-trifluoroethyl)amidehydrochloride2-AMino-N-(2Fluralaner-014Fluralaner-014-HClFluralaner Impurity 12-trifluoroethyl)acetaMide hydrochloride2-Amino-N-(2,2,2-trifluoroethyl)acetamide hydrochlode

SCHEMBL1289973WWB33139AKOS008013808DS-9384SB30984SY121034CS-0136950EN300-44082

Database identifiers

CAS: 1171331-39-7
PubChem CID: 42913698
EC Number: 806-518-0

Properties

Computed structural properties

Topological polar surface area: 55.1 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 5
Rotatable bonds: 2
Heavy atoms: 11
Formal charge: 0
Complexity: 122

Physicochemical properties

storage temp.: Inert atmosphere,Room Temperature
InChI: InChI=1S/C4H7F3N2O.ClH/c5-4(6,7)2-9-3(10)1-8;/h1-2,8H2,(H,9,10);1H
InChIKey: DBNFKWRZLGVLSH-UHFFFAOYSA-N
SMILES: N(CC(F)(F)F)C(=O)CN.Cl
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
HS Code: 2922498590 · 2922498590
REACH Registrations: Active

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 60% (3 of 5) of all reports.

Warning

H315 (40%): Causes skin irritation [Warning Skin corrosion/irritation]

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 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.