Cas no 5256-66-6 (Cyclohexanol,2-methyl-5-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel-)
5256-66-6 structure
Product Name:Cyclohexanol,2-methyl-5-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel-
CAS No:5256-66-6
MF:C12H22O2
MW:198.301884174347
CID:376935
PubChem ID:110636
Update Time:2025-04-19
Cyclohexanol,2-methyl-5-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanol,2-methyl-5-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel-
- (1alpha,2beta,5alpha)-5-(isopropyl)-2-methylcyclohexyl acetate
- ,5α)-5-(isopropyl)-2-methylcyclohexyl acetate
- Carvomenthyl acetate
- AI3-03437
- NS00122439
- Neocarvomenthyl acetate
- DTXSID701158049
- 5256-66-6
- JAKFDYGDDRCJLY-YUSALJHKSA-N
- EINECS 226-058-9
- Cyclohexanol, 2-methyl-5-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel-
- Cyclohexanol, 2-methyl-5-(1-methylethyl)-, acetate, (1alpha,2beta,5alpha)-
-
- Inchi： 1S/C12H22O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11-,12-/m1/s1
- InChI Key： JAKFDYGDDRCJLY-YUSALJHKSA-N
- SMILES： O(C(C)=O)[C@@H]1C[C@H](C(C)C)CC[C@H]1C
Computed Properties
- Exact Mass: 198.16206
- Monoisotopic Mass: 198.162
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 199
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.92
- Boiling Point: 229.1°Cat760mmHg
- Flash Point: 94.4°C
- Refractive Index: 1.448
- PSA: 26.3
Cyclohexanol,2-methyl-5-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel- Related Literature
-
Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
5256-66-6 (Cyclohexanol,2-methyl-5-(1-methylethyl)-, 1-acetate, (1R,2R,5R)-rel-) Related Products
- 29066-34-0(menthyl acetate)
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- 76-49-3(Bornyl acetate)
- 77341-67-4(4-(((1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl)oxy)-4-oxobutanoic acid)
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- 77-54-3((+)-cedryl acetate)
- 89-48-5((±)-Menthyl Acetate)
- 5726-19-2(2-Methylcyclohexyl Acetate)
- 125-12-2(isobornyl acetate)
- 88-41-5(2-Tert-Butylcyclohexyl acetate)
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