N-Benzyl-N-methylethanolamine
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N-Benzyl-N-methylethanolamine
structure -
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CAS No:
101-98-4
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Formula:
C10H15NO
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Chemical Name:
N-Benzyl-N-methylethanolamine
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Synonyms:
Ethanol,2-[methyl(phenylmethyl)amino]-;Ethanol,2-(benzylmethylamino)-;2-[Methyl(phenylmethyl)amino]ethanol;N-Methyl-N-benzylethanolamine;2-(Benzylmethylamino)ethanol;2-(N-Methylbenzylamino)ethanol;N-Benzyl-N-methyl-2-aminoethanol;β-(N-Benzyl-N-methylamino)ethanol;N-Benzyl-N-methylethanolamine;2-(N-benzyl-N-methylamino)ethanol;Benzyl(2-hydroxyethyl)methylamine;N-Benzyl-N-methyl(2-hydroxyethyl)amine;2-[Benzyl(methyl)amino]ethan-1-ol;53014-43-0
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CAS No:
N-Benzyl-N-methylethanolamine Basic Attributes
165.23
165.23
366412
202-994-3
61LYX8089C
DTXSID5059242
29214990
Characteristics
23.5
1.3
Clear , colourless slightly viscous liquid
1.017 g/mL at 25 °C(lit.)
100-105 °C @ Press: 2 Torr
>230 °F
n 20/D 1.529(lit.)
Keep away from heat, sparks, and flame. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep containers tightly closed.
0.00788mmHg at 25°C
Safety Information
NONH for all modes of transport
3
36/37/38
26-37/39-24/25
Xi
Stable at room temperature in closed containers under normal storage and handling conditions.
P261-P305 + P351 + P338
H315-H319-H335
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 45 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
N-Benzyl-N-methylethanolamine Use and Manufacturing
First, benzyl chloride and ethanolamine are reacted to obtain 2-(N-benzyl)aminoethanol, and then reacted with paraformaldehyde in formic acid at a temperature of 70-80°C to obtain N-benzyl-N-methylethanolamine.
Used as an intermediate of calcium antagonist Nicardipine.
Ethanol, 2-[methyl(phenylmethyl)amino]-: ACTIVE
Computed Properties
Molecular Weight:165.23
XLogP3:1.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:165.115364102
Monoisotopic Mass:165.115364102
Topological Polar Surface Area:23.5
Heavy Atom Count:12
Complexity:110
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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