2E4Mz-cn

C₉H₁₃N₃CAS 23996-25-0163.22 g/mol

Open in Covalent MOL file

Nitrile

Properties

Molecular formula: C₉H₁₃N₃
Molar mass: 163.22 g/mol
Exact mass: 163.1109 Da
logP: 1.67Crippen estimate
Polar surface area: 41.6 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

Danger

H301 Toxic if swallowed45.4% of notifiers
H302 Harmful if swallowed41.7% of notifiers
H315 Causes skin irritation86.1% of notifiers
H318 Causes serious eye damage57.4% of notifiers
H319 Causes serious eye irritation41.7% of notifiers
H335 May cause respiratory irritation50% of notifiers
H412 Harmful to aquatic life with long lasting effects13% of notifiers

Aggregated from 108 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

23996-25-0

SMILES

CCc1nc(C)cn1CCC#N

InChIKey

UIDDPPKZYZTEGS-UHFFFAOYSA-N

InChI

InChI=1S/C9H13N3/c1-3-9-11-8(2)7-12(9)6-4-5-10/h7H,3-4,6H2,1-2H3

Weigh it out

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

Names and synonyms

11 names

1H-Imidazole-1-propanenitrile, 2-ethyl-4-methyl-
Imidazole-1-propionitrile, 2-ethyl-4-methyl-
2-Ethyl-4-methyl-1H-imidazole-1-propanenitrile
1-(2-Cyanoethyl)-2-ethyl-4-methylimidazole
1-Cyanoethyl-2-ethyl-4-methylimidazole
1-(Cyanethyl)-2-ethyl-4-methylimidazole
Curezol 2E4MZ-CN
Curimid CN
Epicure EM 24CN
Curamid CN
1-(2-Cynaoethyl)-2-ethyl-4-methylimidazole

Work with 2E4Mz-cn

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

1-Cyanoethyl-2-methylimidazole23996-55-643 % similar 3-(2-Methyl-4-nitro-1H-imidazol-1-yl)propionitrile89128-08-541 % similar 2Pz-cn23996-12-534 % similar 3-(2-Oxo-5-(trifluoromethyl)pyridin-1(2H)-yl)propanenitrile175277-71-133 % similar 2-Ethyl-4-methyl thiazole15679-12-632 % similar 2-Ethyl-3,5-dimethylpyrazine13925-07-030 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-(4-Pyridyl)piperazine1008-91-9 Pyridinylpiperazine34803-66-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook