2-Ethoxy-3-isopropylpyrazine

Base Information

• Chemical Name: 2-Ethoxy-3-isopropylpyrazine
• CAS No.: 72797-16-1
• Molecular Formula: C9H14N2O
• Molecular Weight: 166.22
• Hs Code.: 2933990090
• European Community (EC) Number: 276-847-7
• UNII: SU7E06NLO9
• DSSTox Substance ID: DTXSID2072598
• Nikkaji Number: J318.832I
• Wikidata: Q27289402
• Mol file: 72797-16-1.mol

Synonyms:2-Ethoxy-3-isopropylpyrazine;72797-16-1;2-ethoxy-3-propan-2-ylpyrazine;Pyrazine, 2-ethoxy-3-(1-methylethyl)-;EINECS 276-847-7;UNII-SU7E06NLO9;SU7E06NLO9;2-Ethoxy-3-isopropyl pyrazine;2-isopropyl-3-ethoxypyrazine;SCHEMBL430323;DTXSID2072598;FEMA NO. 4632;LTAUBPVQMBOANV-UHFFFAOYSA-;2-ethoxy-3-(propan-2-yl)pyrazine;XCA79716;GS2588;MFCD00038029;AKOS015839003;2-Ethoxy-3-isopropylpyrazine, AldrichCPR;AS-59451;CS-0313899;E0716;FT-0716964;2-ETHOXY-3-(1-METHYLETHYL) PYRAZINE;T72883;A914695;W-104479;Q27289402

Chemical Property of 2-Ethoxy-3-isopropylpyrazine

Chemical Property:

• Vapor Pressure: 0.0995mmHg at 25°C
• Refractive Index: 1.487
• Boiling Point: 230.5 °C at 760 mmHg
• PKA: 0.88±0.10(Predicted)
• Flash Point: 78.8 °C
• PSA: 35.01000
• Density: 0.998 g/cm³
• LogP: 1.99870
• Storage Temp.: 2-8°C
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 166.110613074
• Heavy Atom Count: 12
• Complexity: 128

Purity/Quality:

99% ^*data from raw suppliers

2-Ethoxy-3-isopropylpyrazine >95.0%(GC)(T) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=NC=CN=C1C(C)C
• Uses: Used in daily cosmetics for fragrance.; Temporarily allowed food spice for flavoring coffee, cocoa, potatoes, mushrooms, and vegetables.
• Production Methods: Condensation of isoleucine amide and glyoxal, followed by methylation with diazomethane.