aziridine

• ChemBase ID: 126004
• Molecular Formular: C2H5N
• Molecular Mass: 43.0678
• Monoisotopic Mass: 43.04219917
• SMILES: C1CN1
• Canonical SMILES: N1CC1
• InChI: InChI=1S/C2H5N/c1-2-3-1/h3H,1-2H2
• InChIKey: NOWKCMXCCJGMRR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: aziridine
• IUPAC Traditional name: aziridine
• Synonyms: Azacyclopropane; Ethylene imine; Aziridine; Polyethyleneimine, branched, M.W. 10,000; 聚乙烯亚胺, 支链的, M.W. 10,000

Database IDs

• CAS Number: 151-56-4; 9002-98-6
• EC Number: 205-793-9
• MDL Number: MFCD00803910
• PubChem SID: 162220347
• PubChem CID: 9033
• CHEBI ID: 30969
• CHEMBL: 540990
• Chemspider ID: 8682
• KEGG ID: C11687
• Wikipedia Title: Aziridine

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.8231056
• LogD (pH = 7.4): -1.0891287
• Log P: -0.36440343
• Molar Refractivity: 12.7244 cm^3
• Polarizability: 5.2136083 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: miscible all proportions in water
• Apperance: Clear colorless oily liquid; Liquid
• Melting Point: -77.9 °C, 195.3 K, -108.2 °F
• Boiling Point: 56°C
• Flash Point: -11 °C
• Density: 0.8321 g/mL 20 °C

Safety Information

• RTECS: TQ7915000
• European Hazard Symbols: X
• Risk Statements: 22
• Safety Statements: 36
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Hazard statements: H302
• GHS Precautionary statements: P264-P270-P301+P312-P330-P501A

Product Information

• Purity: 99%