N-Ethyl-2-methylallylamine

C₆H₁₃NCAS 18328-90-099.18 g/mol

Open in Covalent MOL file

Alkene Secondary amine

Properties

Molecular formula: C₆H₁₃N
Molar mass: 99.18 g/mol
Exact mass: 99.1048 Da
Boiling point: 102 °C
logP: 1.17Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 3

Hazards

Danger

H225 Highly Flammable liquid and vapor88.9% of notifiers
H302 Harmful if swallowed86.7% of notifiers
H312 Harmful in contact with skin86.7% of notifiers
H314 Causes severe skin burns and eye damage88.9% of notifiers
H332 Harmful if inhaled86.7% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, P501

Identifiers

CAS number

18328-90-0

SMILES

C=C(C)CNCC

InChIKey

AXTLFVLHXSDZOW-UHFFFAOYSA-N

InChI

InChI=1S/C6H13N/c1-4-7-5-6(2)3/h7H,2,4-5H2,1,3H3

Weigh it out

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

Names and synonyms

6 names

2-Propen-1-amine, N-ethyl-2-methyl-
Allylamine, N-ethyl-2-methyl-
N-Ethyl-2-methyl-2-propen-1-amine
N-Ethylmethallylamine
N-2-Methylallyl-N-ethylamine
N-Ethyl(2-methyl-2-propenyl)amine

Work with N-Ethyl-2-methylallylamine

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

2-Methyl-1-butene563-46-243 % similar 2,5-Dimethyl-1,5-hexadiene627-58-741 % similar Diethylamine109-89-740 % similar 2-Methyl-1-pentene763-29-140 % similar 2-Methyl-1-hexene6094-02-637 % similar N,N'-Diethylethylenediamine111-74-036 % similar Methallyl bromide1458-98-636 % similar Methallyl alcohol513-42-836 % similar

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

Same formula

Cyclohexylamine108-91-8 2-Methylpiperidine109-05-7 Azepane111-49-9 (S)-(+)-2-Methylpiperidine3197-42-0 2,2-Dimethylpyrrolidine35018-15-6 3-Methylpiperidine626-56-2 4-Methylpiperidine626-58-4 N-Methylpiperidine626-67-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook