Cas no 79012-29-6 (1,3-Dioxane-2-acetaldehyde)
1,3-Dioxane-2-acetaldehyde structure
Product Name:1,3-Dioxane-2-acetaldehyde
CAS No:79012-29-6
MF:C6H10O3
MW:130.141802310944
CID:533534
PubChem ID:11007928
Update Time:2025-04-19
1,3-Dioxane-2-acetaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Dioxane-2-acetaldehyde
- 2-(1,3-dioxan-2-yl)acetaldehyde
- 79012-29-6
- SCHEMBL11351354
- DTXSID20451575
-
- Inchi： 1S/C6H10O3/c7-3-2-6-8-4-1-5-9-6/h3,6H,1-2,4-5H2
- InChI Key： XSUHDQDPZLKTQB-UHFFFAOYSA-N
- SMILES： O1CCCOC1CC=O
Computed Properties
- Exact Mass: 130.062994177g/mol
- Monoisotopic Mass: 130.062994177g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 86.3
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.3
- Topological Polar Surface Area: 35.5?2
1,3-Dioxane-2-acetaldehyde Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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5. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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