1-Ethylpyrrolidine
Properties
- Molecular formula
- C6H13N
- Molar mass
- 99.18 g/mol
- Exact mass
- 99.1048 Da
- Density
- 0.8156 g/mL (at 20 °C)
- Melting point
- 102–104 °C
- Boiling point
- 104 °C
- logP
- 1.10Crippen estimate
- Polar surface area
- 3.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H225 Highly Flammable liquid and vapor100% of notifiers
- H314 Causes severe skin burns and eye damage100% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, P501
Identifiers
CAS number
7335-06-0SMILES
CCN1CCCC1InChIKey
ONQBOTKLCMXPOF-UHFFFAOYSA-NInChI
InChI=1S/C6H13N/c1-2-7-5-3-4-6-7/h2-6H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
3 names
- Pyrrolidine, 1-ethyl-
- N-Ethylpyrrolidine
- N-Ethyltetrahydropyrrole
Work with 1-Ethylpyrrolidine
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-Ethylpiperidine766-09-693 % similar
1,4-Diethylpiperazine6483-50-771 % similar
N,N,N′,N′-Tetraethylethylenediamine150-77-660 % similar
N,N-Diethyl-1,4-butanediamine27431-62-560 % similar
Triethylamine121-44-857 % similar
1-Ethylhomopiperazine3619-73-657 % similar
3-Chloro-N,N-diethyl-1-propanamine104-77-855 % similar
N,N-Diethyl-1,3-propanediamine104-78-955 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.