Cas no 55944-71-3 (2H-Pyran,2-[(7-chloroheptyl)oxy]tetrahydro-)
![2H-Pyran,2-[(7-chloroheptyl)oxy]tetrahydro- structure](https://ossimg.kuujia.com/scimg/56000/55944-71-3x500.png)
55944-71-3 structure
Product Name:2H-Pyran,2-[(7-chloroheptyl)oxy]tetrahydro-
CAS No:55944-71-3
MF:C12H23ClO2
MW:234.762823343277
CID:370905
PubChem ID:91953
Update Time:2025-04-19
2H-Pyran,2-[(7-chloroheptyl)oxy]tetrahydro- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Pyran,2-[(7-chloroheptyl)oxy]tetrahydro-
- 2-((7-Chloroheptyl)oxy)tetrahydro-2H-pyran
- 2-(7-chloroheptoxy)oxane
- 2-[(7-Chloroheptyl)oxy]tetrahydro-2H-pyran
- 2H-Pyran, 2-((7-chloroheptyl)oxy)tetrahydro-
- 2H-Pyran, 2-[(7-chloroheptyl)oxy]tetrahydro-
- 55944-71-3
- DTXSID50884690
-
- Inchi： 1S/C12H23ClO2/c13-9-5-2-1-3-6-10-14-12-8-4-7-11-15-12/h12H,1-11H2
- InChI Key： CBGSMMHEWYXIKA-UHFFFAOYSA-N
- SMILES： ClCCCCCCCOC1CCCCO1
Computed Properties
- Exact Mass: 234.13879
- Monoisotopic Mass: 234.139
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 8
- Complexity: 142
- 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: 3.5
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- Density: 1
- Boiling Point: 318.5°C at 760 mmHg
- Flash Point: 98.5°C
- Refractive Index: 1.46
- PSA: 18.46
2H-Pyran,2-[(7-chloroheptyl)oxy]tetrahydro- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Jason Wan Lab Chip, 2020,20, 4528-4538
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