Cas no 54298-90-7 (Methyl 4-(prop-1-en-2-yl)cyclohex-1-enecarboxylate)
54298-90-7 structure
Product Name:Methyl 4-(prop-1-en-2-yl)cyclohex-1-enecarboxylate
CAS No:54298-90-7
MF:C11H16O2
MW:180.243543624878
CID:940551
PubChem ID:4453437
Update Time:2024-02-29
Methyl 4-(prop-1-en-2-yl)cyclohex-1-enecarboxylate Chemical and Physical Properties
Names and Identifiers
-
- methyl perillate
- Methyl 4-(prop-1-en-2-yl)cyclohex-1-enecarboxylate
- Perillic acid methyl ester
- JMMLJZJUVKEVCK-UHFFFAOYSA-N
- ST51006694
- methyl (4S)-4-(1-methylvinyl)cyclohex-1-enecarboxylate
- METHYL 4-(PROP-1-EN-2-YL)CYCLOHEX-1-ENE-1-CARBOXYLATE
- FT-0695826
- 54298-90-7
- AKOS024370819
- SCHEMBL1810087
-
- Inchi： 1S/C11H16O2/c1-8(2)9-4-6-10(7-5-9)11(12)13-3/h6,9H,1,4-5,7H2,2-3H3
- InChI Key： JMMLJZJUVKEVCK-UHFFFAOYSA-N
- SMILES： O(C)C(C1=CCC(C(=C)C)CC1)=O
Computed Properties
- Exact Mass: 180.115029749g/mol
- Monoisotopic Mass: 180.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 251
- 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
- Topological Polar Surface Area: 26.3
Experimental Properties
- Density: 0.999?g/mL?at 25?°C(lit.)
- Boiling Point: 68-72?°C0.04?mm Hg(lit.)
- Flash Point: >230?°F
- Refractive Index: n20/D 1.491(lit.)
Methyl 4-(prop-1-en-2-yl)cyclohex-1-enecarboxylate Related Literature
-
H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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2. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Camelia Henríquez,Edwin Palacio,Víctor Cerdà Anal. Methods, 2014,6, 8494-8504
Related Categories
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Prenol lipids Menthane monoterpenoids
- Solvents and Organic Chemicals Organic Compounds Lipids and lipid-like molecules Prenol lipids Monoterpenoids Menthane monoterpenoids
- Natural Products and Extracts Plant Extracts Plant based Ammodaucus leucotrichus
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