4-{2-[2-(morpholin-4-yl)ethoxy]ethyl}morpholine

• ChemBase ID: 147828
• Molecular Formular: C12H24N2O3
• Molecular Mass: 244.33056
• Monoisotopic Mass: 244.17869264
• SMILES: C1COCCN1CCOCCN1CCOCC1
• Canonical SMILES: O(CCN1CCOCC1)CCN1CCOCC1
• InChI: InChI=1S/C12H24N2O3/c1-7-15-8-2-13(1)5-11-17-12-6-14-3-9-16-10-4-14/h1-12H2
• InChIKey: ZMSQJSMSLXVTKN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-{2-[2-(morpholin-4-yl)ethoxy]ethyl}morpholine
• IUPAC Traditional name: 4-{2-[2-(morpholin-4-yl)ethoxy]ethyl}morpholine
• Synonyms: 4,4′-(Oxydi-2,1-ethanediyl)bismorpholine; 4,4'-(Oxybis(ethane-2,1-diyl))dimorpholine; 2,2-二吗啉基二乙基醚

Database IDs

• CAS Number: 6425-39-4
• EC Number: 229-194-7
• MDL Number: MFCD00072740
• PubChem SID: 24866573; 162242011
• PubChem CID: 80900

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 0
• LogD (pH = 5.5): -2.7655404
• LogD (pH = 7.4): -0.4880892
• Log P: -0.27516243
• Molar Refractivity: 67.1997 cm^3
• Polarizability: 26.515774 Å^3
• Polar Surface Area: 34.17 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 309 °C(lit.)
• Density: 1.06 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.484(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 1
• Risk Statements: 36
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H319
• GHS Precautionary statements: P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Product Information

• Purity: 95+%; 97%
• Empirical Formula (Hill Notation): C12H24N2O3

DETAILS

Sigma Aldrich - 424528

Packaging
100 mL in poly bottle
Application
Catalyst for flexible polyester foams, molded foams, and moisture-cured foams and coatings. Good blowing catalyst that does not cause cross-linking.