Cas no 13021-50-6 (2-Propanol,1-ethoxy-3-(1-methylethoxy)-)
13021-50-6 structure
Product Name:2-Propanol,1-ethoxy-3-(1-methylethoxy)-
2-Propanol,1-ethoxy-3-(1-methylethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propanol,1-ethoxy-3-(1-methylethoxy)-
- 1-Ethoxy-3-isopropoxy-2-propanol
- 1-ethoxy-3-propan-2-yloxypropan-2-ol
- 1-Aethoxy-3-isopropoxy-propan-2-ol
- 1-ethoxy-3-iso-propoxy-2-propanol
- 1-ethoxy-3-isopropoxy-propan-2-ol
- 1-Ethoxy-3-isopropoxypropan-2-ol
- 1-Ethoxy-3-isopropyloxy-propan-2-ol
- 2-Propanol, 1-ethoxy-3-isopropoxy-
- AC1L3URO
- amp
- BRN 1739142
- NSC25568
- O1-Aethyl-O3-isopropyl-glycerin
- WLN: 2O1YQ1OY1&
- 13021-50-6
- NSC 25568
- NSC-25568
- AKOS018124067
- 1-Ethoxy-3-(1-methylethoxy)-2-propanol
- WLN: 2O1YQ1OY1&1
- DTXSID101030277
- 2-Propanol, 1-ethoxy-3-(1-methylethoxy)-
-
- Inchi： 1S/C8H18O3/c1-4-10-5-8(9)6-11-7(2)3/h7-9H,4-6H2,1-3H3
- InChI Key： ZATQNAGGARBGCM-UHFFFAOYSA-N
- SMILES： O(C(C)C)CC(COCC)O
Computed Properties
- Exact Mass: 162.12564
- Monoisotopic Mass: 162.125594432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 83.4
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.5
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- Density: 0.9937 (rough estimate)
- Boiling Point: 228.93°C (rough estimate)
- Refractive Index: 1.4100 (estimate)
- PSA: 38.69
2-Propanol,1-ethoxy-3-(1-methylethoxy)- Related Literature
-
José I. García,Héctor García-Marín,José A. Mayoral,Pascual Pérez Green Chem. 2013 15 2283
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