M26305
N-Methylacetamide
≥99%
Synonym(s):
Acetylmethylamine
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About This Item
Linear Formula:
CH3CONHCH3
CAS Number:
Molecular Weight:
73.09
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
201-182-6
Beilstein/REAXYS Number:
1071255
MDL number:
Assay:
≥99%
Quality Level
assay
≥99%
refractive index
n20/D 1.433 (lit.)
bp
204-206 °C (lit.)
mp
26-28 °C (lit.)
density
0.957 g/mL at 25 °C (lit.)
SMILES string
CNC(C)=O
InChI
1S/C3H7NO/c1-3(5)4-2/h1-2H3,(H,4,5)
InChI key
OHLUUHNLEMFGTQ-UHFFFAOYSA-N
Related Categories
Application
N-Methylacetamide can be used:
- To synthesize N-methyl-N-(3-thienyl)acetamide by reacting with 3-bromothiophene in the presence of CuI catalyst and N,N′-dimethylethylenediamine.(1)
- As a ligand to synthesize the zirconium(IV) complex, Zr(MeC(O)NMe)4 by reacting with tetrakis(dimethylamido)zirconium.(2)
signalword
Danger
hcodes
Hazard Classifications
Repr. 1B
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 1
flash_point_f
240.8 °F
flash_point_c
116 °C
ppe
Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
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Hochan Lee et al.
The journal of physical chemistry. A, 116(1), 347-357 (2011-11-18)
IR probes have been extensively used to monitor local electrostatic and solvation dynamics. Particularly, their vibrational frequencies are highly sensitive to local solvent electric field around an IR probe. Here, we show that the experimentally measured vibrational frequency shifts can
Jakub Kaminský et al.
The journal of physical chemistry. A, 115(1), 30-34 (2010-12-15)
For spectroscopic studies of peptide and protein thermal denaturation it is important to single out the contribution of the solvent to the spectral changes from those originated in the molecular structure. To obtain insights into the origin and size of
M Albertí et al.
Physical chemistry chemical physics : PCCP, 13(18), 8422-8432 (2011-02-19)
A recently formulated intermolecular potential has been adapted to describe the interaction of the N-methylacetamide (NMA) dimer and of the NMA-H(2)O adduct. The pure electrostatic component of the intermolecular potential functional representation is as usual expressed in terms of a
Adolfo Bastida et al.
The journal of physical chemistry. A, 114(43), 11450-11461 (2010-10-12)
Nonequilibrium molecular dynamics (MD) simulations and instantaneous normal mode (INMs) analyses are used to study the vibrational relaxation of the C-H stretching modes (ν(s)(CH₃)) of deuterated N-methylacetamide (NMAD) in aqueous (D2O) solution. The INMs are identified unequivocally in terms of
Haibo Yu et al.
Journal of the American Chemical Society, 132(31), 10847-10856 (2010-08-05)
Most current biomolecular simulations are based on potential energy functions that treat the electrostatic energy as a sum of pairwise Coulombic interactions between effective fixed atomic charges. This approximation, in which many-body induced polarization effects are included in an average
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