7-Ethylindole

C10H11NCAS 22867-74-9145.20 g/mol

Open in Covalent MOL file
HN

Properties

Molecular formula
C10H11N
Molar mass
145.20 g/mol
Exact mass
145.0891 Da
logP
2.73Crippen estimate
Polar surface area
15.8 Ų
H-bond donors / acceptors
1 / 0
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 13 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P354+P338, P317, P321, P332+P317, P362+P364

Identifiers

CAS number
22867-74-9
SMILES
CCC1=CC=CC2=C1NC=C2
InChIKey
PIIZLMYXLGYWTN-UHFFFAOYSA-N
InChI
InChI=1S/C10H11N/c1-2-8-4-3-5-9-6-7-11-10(8)9/h3-7,11H,2H2,1H3

Weigh it out

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

Work with 7-Ethylindole

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

1H-Indole-7-methanol1074-87-967 % similar 7-Methylindole933-67-552 % similar 1-Ethylnaphthalene1127-76-048 % similar 7-Bromoindole51417-51-748 % similar 7-Chloroindole53924-05-348 % similar 7-Methoxyindole3189-22-847 % similar 7-Hydroxyindole2380-84-947 % similar 7-Fluoro-1H-indole387-44-047 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,5-Dimethylindole1196-79-8 2,5-Dimethylbenzeneacetonitrile16213-85-7 4-Ethynyl-N,N-dimethylaniline17573-94-3 Benzenebutanenitrile2046-18-6 2,4,6-Trimethylbenzonitrile2571-52-0 3,5-Dimethylbenzeneacetonitrile39101-54-7 4-Ethylphenylacetonitrile51632-28-1 α-Ethylbenzeneacetonitrile769-68-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook