Cas no 933-12-0 (Cyclohexene,3,5,5-trimethyl-)
Cyclohexene,3,5,5-trimethyl- structure
Product Name:Cyclohexene,3,5,5-trimethyl-
Cyclohexene,3,5,5-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexene,3,5,5-trimethyl-
- 3,3,5-TRIMETHYL CYCLOHEXENE
- 3,5,5-TRIMETHYLCYCLOHEXENE
- 3,5,5-trimethyl-1-hexene
- 3,5,5-trimethylcyclohex-1-ene
- 3,5,5-Trimethyl-cyclohexen
- 3,5,5-trimethyl-cyclohexene
- Cyclohexene,3,5,5-trimethyl
- 933-12-0
- NCIOpen2_000504
- NSC73960
- .delta.-Cyclogeraniolene
- Cyclohexene, 3,5,5-trimethyl- (VAN)
- EINECS 213-265-4
- 3,5,5-Trimethyl-1-cyclohexene #
- NS00042285
- NSC 73960
- Cyclohexene,5,5-trimethyl- (VAN8C
- NSC-73960
- I -cyclogeraniolene
- delta-Cyclogeraniolene
- FT-0633136
- Cyclohexene, 3,5,5-trimethyl-
- DTXSID00883618
- CBERVMGFVLWZSU-UHFFFAOYSA-N
-
- Inchi： 1S/C9H16/c1-8-5-4-6-9(2,3)7-8/h4-5,8H,6-7H2,1-3H3
- InChI Key： CBERVMGFVLWZSU-UHFFFAOYSA-N
- SMILES： C1(C)(C)CC=CC(C)C1
Computed Properties
- Exact Mass: 124.12500
- Monoisotopic Mass: 124.125
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 120
- 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
- Topological Polar Surface Area: 0A^2
- XLogP3: 3.4
Experimental Properties
- Density: 0.7934 (estimate)
- Melting Point: -91.55°C
- Boiling Point: 133.61°C
- Flash Point: 16.1°C
- Refractive Index: 1.4524 (estimate)
- PSA: 0.00000
- LogP: 2.99870
Cyclohexene,3,5,5-trimethyl- Related Literature
-
Soumaya Khlifi,Gregory Mouille,Jonathan Farjon Anal. Methods, 2017,9, 2328-2333
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Camelia Henríquez,Edwin Palacio,Víctor Cerdà Anal. Methods, 2014,6, 8494-8504
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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