N-Benzyl-N-methylethanolamine

C₁₀H₁₅NOCAS 101-98-4165.24 g/mol

Open in Covalent MOL file

Alcohol Tertiary amine

Properties

Molecular formula: C₁₀H₁₅NO
Molar mass: 165.24 g/mol
Exact mass: 165.1154 Da
Boiling point: 100–105 °C (at 2 Torr)
logP: 1.11Crippen estimate
Polar surface area: 23.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 4

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation97.8% of notifiers
H335 May cause respiratory irritation97.8% of notifiers

Aggregated from 46 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

101-98-4

SMILES

CN(CCO)Cc1ccccc1

InChIKey

WOUANPHGFPAJCA-UHFFFAOYSA-N

InChI

InChI=1S/C10H15NO/c1-11(7-8-12)9-10-5-3-2-4-6-10/h2-6,12H,7-9H2,1H3

Weigh it out

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

Names and synonyms

12 names

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
2-(N-Benzyl-N-methylamino)ethanol
Benzyl(2-hydroxyethyl)methylamine
N-Benzyl-N-methyl(2-hydroxyethyl)amine
2-[Benzyl(methyl)amino]ethan-1-ol

Work with N-Benzyl-N-methylethanolamine

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

Similar compounds

2-[Bis(phenylmethyl)amino]ethanol101-06-462 % similar 2,2'-((Phenylmethyl)imino)bisethanol101-32-662 % similar Methyl diethanolamine105-59-950 % similar 1-Methyl-4-(phenylmethyl)piperazine hydrochloride (1:1)374898-00-750 % similar 2-(Methylphenylamino)ethanol93-90-350 % similar Dimethylbenzylamine103-83-348 % similar Phenethyl alcohol60-12-846 % similar Pargyline hydrochloride306-07-046 % similar

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

Same formula

3-[1-(Dimethylamino)ethyl]phenol105601-04-5 2-Amino-4-tert-butylphenol1199-46-8 (S)-3-[1-(Dimethylamino)ethyl]phenol139306-10-8 N-Ethyl-4-methoxybenzylamine22993-76-6 N-Methyl-N-(2-hydroxyethyl)-p-toluidine2842-44-6 Ephedrine299-42-3 Perillartine30950-27-7 (-)-Pseudoephedrine321-97-1

Elsewhere

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