Cas no 764-81-8 (hydroperoxide, heptyl)
hydroperoxide, heptyl structure
Product Name:hydroperoxide, heptyl
hydroperoxide, heptyl Chemical and Physical Properties
Names and Identifiers
-
- hydroperoxide, heptyl
- 1-hydroperoxyheptane
- Heptyl hydroperoxide
- 1-Heptyl hydroperoxide
- n-C7H15OOH
- dioxanonane
- XIOGAMSXYSPUSI-UHFFFAOYSA-N
- DTXSID80227233
- 764-81-8
- SCHEMBL1804145
-
- Inchi： 1S/C7H16O2/c1-2-3-4-5-6-7-9-8/h8H,2-7H2,1H3
- InChI Key： XIOGAMSXYSPUSI-UHFFFAOYSA-N
- SMILES： O(CCCCCCC)O
Computed Properties
- Exact Mass: 132.11508
- Monoisotopic Mass: 132.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 6
- Complexity: 46.2
- 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: 2.5
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- Density: 0.9202 (rough estimate)
- Melting Point: 35.5°C
- Boiling Point: 184.14°C (rough estimate)
- Refractive Index: 1.4500 (estimate)
- PSA: 29.46
hydroperoxide, heptyl Related Literature
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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