Cas no 89435-16-5 (1,3-Dioxan-2-one, 5-propyl-)
1,3-Dioxan-2-one, 5-propyl- structure
Product Name:1,3-Dioxan-2-one, 5-propyl-
CAS No:89435-16-5
MF:C7H12O3
MW:144.168382644653
CID:600933
PubChem ID:69478375
Update Time:2025-04-19
1,3-Dioxan-2-one, 5-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Dioxan-2-one, 5-propyl-
- 5-propyl-1,3-dioxan-2-one
- SCHEMBL5532586
- DTXSID20740633
- 89435-16-5
-
- Inchi： 1S/C7H12O3/c1-2-3-6-4-9-7(8)10-5-6/h6H,2-5H2,1H3
- InChI Key： DKXBERCQHBQWNO-UHFFFAOYSA-N
- SMILES： O1C(=O)OCC(C1)CCC
Computed Properties
- Exact Mass: 144.078644241g/mol
- Monoisotopic Mass: 144.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 112
- 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: 2
- Topological Polar Surface Area: 35.5?2
1,3-Dioxan-2-one, 5-propyl- Related Literature
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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