2-Cyclopropyl-1H-imidazole

C₆H₈N₂CAS 89532-38-7108.14 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₈N₂
Molar mass: 108.14 g/mol
Exact mass: 108.0687 Da
logP: 1.29Crippen estimate
Polar surface area: 28.7 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

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

Identifiers

CAS number

89532-38-7

SMILES

C1CC1C2=NC=CN2

InChIKey

MBQKTXUCJWIHQQ-UHFFFAOYSA-N

InChI

InChI=1S/C6H8N2/c1-2-5(1)6-7-3-4-8-6/h3-5H,1-2H2,(H,7,8)

Weigh it out

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

Work with 2-Cyclopropyl-1H-imidazole

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-Isopropylimidazole36947-68-954 % similar 2,2'-Biimidazole492-98-842 % similar 2-Ethylimidazole1072-62-438 % similar 1H-Imidazole-2-methanol3724-26-338 % similar 2-Aminomethyl-1H-imidazole53332-80-238 % similar 2-Chloro-1H-imidazole16265-04-637 % similar 2-Bromo-1H-imidazole16681-56-437 % similar 2-Iodo-1H-imidazole3034-62-637 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Cyclopropyl-1H-pyrazole100114-57-6 Phenylhydrazine100-63-0 P-Phenylenediamine106-50-3 M-Phenylenediamine108-45-2 2,6-Dimethylpyrazine108-50-9 Adiponitrile111-69-3 4-(Methylamino)pyridine1121-58-0 2,5-Dimethylpyrazine123-32-0

Elsewhere

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