N-Ethyl-1-naphthalenamine

C₁₂H₁₃NCAS 118-44-5171.24 g/mol

Open in Covalent MOL file

Secondary amine

Properties

Molecular formula: C₁₂H₁₃N
Molar mass: 171.24 g/mol
Exact mass: 171.1048 Da
Melting point: 164–165 °C (decomposes)
Boiling point: 305 °C
logP: 3.27Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H311 Toxic in contact with skin55.9% of notifiers
H312 Harmful in contact with skin44.1% of notifiers
H332 Harmful if inhaled24.2% of notifiers
H400 Very toxic to aquatic life21.5% of notifiers
H411 Toxic to aquatic life with long lasting effects56.5% of notifiers

Aggregated from 186 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P262, P264, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P316, P317, P321, P330, P361+P364, P362+P364, P391, P405, P501

Identifiers

CAS number

118-44-5

SMILES

CCNc1cccc2ccccc12

InChIKey

KDFFXYVOTKKBDI-UHFFFAOYSA-N

InChI

InChI=1S/C12H13N/c1-2-13-12-9-5-7-10-6-3-4-8-11(10)12/h3-9,13H,2H2,1H3

Weigh it out

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

Names and synonyms

8 names

1-Naphthalenamine, N-ethyl-
1-Naphthylamine, N-ethyl-
Ethyl-α-naphthylamine
N-Ethyl-α-naphthylamine
N-Ethyl-1-naphthylamine
1-(Ethylamino)naphthalene
N-Ethyl-1-aminonaphthalene
NSC 8636

Work with N-Ethyl-1-naphthalenamine

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Ethyl-o-toluidine94-68-853 % similar N-Ethyl-2-fluorobenzenamine2707-64-452 % similar N-1-Naphthylethylenediamine dihydrochloride1465-25-451 % similar 1-Naphthylhydrazine hydrochloride2243-56-348 % similar N-Phenylnaphthalen-1-amine90-30-248 % similar N,N'-Di(1-naphthyl)-4,4'-benzidine152670-41-245 % similar 1-Ethylnaphthalene1127-76-045 % similar N-Ethylaniline103-69-545 % similar

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

Same formula

(-)-1-(1-Naphthyl)ethylamine10420-89-0 6-Isopropylquinoline135-79-5 Rasagiline136236-51-6 N-Methyl-1-naphthalenemethanamine14489-75-9 N,N-Dimethyl-2-naphthalenamine2436-85-3 (-)-1-(2-Naphthyl)ethylamine3082-62-0 (+)-1-(1-Naphthyl)ethylamine3886-70-2 1-(1-Naphthyl)ethylamine42882-31-5

Elsewhere

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