Cas no 7356-06-1 (Benzene,[[(6,6-diethoxyhexyl)oxy]methyl]-)
7356-06-1 structure
Product Name:Benzene,[[(6,6-diethoxyhexyl)oxy]methyl]-
CAS No:7356-06-1
MF:C17H28O3
MW:280.402425765991
CID:572637
PubChem ID:230615
Update Time:2025-04-19
Benzene,[[(6,6-diethoxyhexyl)oxy]methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,[[(6,6-diethoxyhexyl)oxy]methyl]-
- 6-benzyloxy-hexanal-diethylacetal;6-Benzyloxy-hexanal-diaethylacetal;
- NSC-25692
- 6,6-diethoxyhexoxymethylbenzene
- 7356-06-1
- DTXSID80282387
- NSC25692
- (6,6-Diethoxyhexyloxymethyl)benzene
-
- Inchi: 1S/C17H28O3/c1-3-19-17(20-4-2)13-9-6-10-14-18-15-16-11-7-5-8-12-16/h5,7-8,11-12,17H,3-4,6,9-10,13-15H2,1-2H3
- InChI Key: LLUDPHAETRUJBA-UHFFFAOYSA-N
- SMILES: O(CC)C(CCCCCOCC1C=CC=CC=1)OCC
Computed Properties
- Exact Mass: 280.20400
- Monoisotopic Mass: 280.204
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 12
- Complexity: 196
- 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: 3.6
- Topological Polar Surface Area: 27.7?2
Experimental Properties
- Density: 0.965
- Boiling Point: 362.9°C at 760 mmHg
- Flash Point: 145.2°C
- Refractive Index: 1.481
- PSA: 27.69000
- LogP: 4.16270
Benzene,[[(6,6-diethoxyhexyl)oxy]methyl]- 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
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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