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Ethylamine, N-methyl-N-nitroso-2,2,2-trifluoro-

HCID 13168
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Basic information

CAS
819-35-2
Standard SMILES
CN(CC(F)(F)F)N=O
InChIKey
LMGJQNSPQYXKLA-UHFFFAOYSA-N
Molecular formula
C3H5F3N2O
Average molar mass
142.08 g/mol
Monoisotopic mass
142.03539727

Names & identifiers

Preferred name
Ethylamine, N-methyl-N-nitroso-2,2,2-trifluoro-
IUPAC
N-methyl-N-(2,2,2-trifluoroethyl)nitrous amide
English name
Nitrosomethyl-2-trifluoroethylamine
Molecular formula
C3H5F3N2O
Molecular weight
142.08

Names & synonyms

819-35-2Nitrosomethyl-2-trifluoroethylamineETHYLAMINE, N-METHYL-N-NITROSO-2,2,2-TRIFLUORO-BRN 1764121DTXSID00231453RefChem:596560DTXCID00153944N-methyl-N-(2,2,2-trifluoroethyl)nitrous amideMethyl(2,2,2-trifluoroethyl)nitrosamine2,2,2-trifluoro-N-methyl-N-nitrosoethanamineUpadacitinib Impurity 201MFCD01726980
Show more names
SY375756

Database identifiers

CAS
819-35-2
PubChem CID
13168
DTXSID
DTXSID00231453
EC Number
982-540-5
Nikkaji
J78.050B

Properties

Computed structural properties

XLogP
1.3
Topological polar surface area
32.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
9
Formal charge
0
Complexity
102

Physicochemical properties

Boiling point
131 · 131-133 °C
Density
1.3544 · 1.3544 (estimate)
pka
-8.966 · -8.966±0.70(predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338
Toxicity
250 mg/plate · mmo-sat 250 mg/plate TCMUD8 1,295,80

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P203, P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

Toxicity
mmo-sat 250 mg/plate TCMUD8 1,295,80
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Related reactions

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Compound notes

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