AromaDb: A Database of Plant's Aroma Molecules

Ethylenimine Details

: IUPAC Name
aziridine
:Chemical Class
:CAS Registry Number
151-56-4
:Description

:Fragrance Type

Physical and Chemical properties

PUBCHEM ID9033
Molecular Weight (mg/mol)43.0678
Molecular FormulaC2H5N
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
IUPAC Nameaziridine
Canonical SMILESC1CN1
PUBCHEM IUPAC INCHIKEYNOWKCMXCCJGMRR-UHFFFAOYSA-N
Solubility Level5
Vapour Pressure2.336

Absorption and Metabolism information

XLOGP3 AA-0.4
CACTVS TPSA21.9
BBB Level4
Absorption Level2
EXT PPB#Prediction0
AlogP98-0.398
EXT CYP2D6#Prediction0

Toxicological Information

Mouse Female FDAMulti-Carcinogen
Mouse Male FDAMulti-Carcinogen
Rat Female FDASingle-Carcinogen
Rat Male FDANon-Carcinogen
Ames PredictionNon-Mutagen
Developmental / Reproductive ToxicityToxic
Rat Oral LD500.104517 g/kg_body_weight
Ocular IrritancySevere
Hepatotoxic#Prediction1
Effected Human GenesACOT8,CES1,PLA2G4A,ACOT2,ACOT4,ACOT7,BAAT,ACOX1,PLA2G1B,PLA2G2A,PLA2G6,ACAA1,PLA2G4B,PLA2G10,PLA2G12A,PLA2G12B,PLA2G2D,PLA2G2E,PLA2G2F,PLA2G5,PLA2G3,ACSL1,HSD17B4,PPARG,SOAT1

Ecological Information

Aerobic Biodegradability PredictionDegradable

Hazard(s) Identification

Physical hazardsnot classified
Health hazards Mild
Environmental hazardsnot classified
About Table Headings

Compound Biological Activity

Serial No.Cas No Gene SymbolOrganismInteraction Interaction ActionsPubMed Id
Serial No.Activity Name DetailsReferences (PubMed)Other details EPA (U.S)Clinical Trials (U.S. NIH)
1 151-56-4 Ethylenimine

Plant Variety and Essential oils

Serial No.Plant NameVariety NameEssential OilCompound Percentage
1 Mulethi Mishri Glucyrrhiza glabra mulethi essential oil

Compound Image


2D Structure

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(External database - ChemAxon)