Cas no 220329-20-4 (Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5S)-rel-)
220329-20-4 structure
Product Name:Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5S)-rel-
CAS No:220329-20-4
MF:C12H20O2
MW:196.286004066467
CID:1405718
PubChem ID:1268040
Update Time:2025-04-20
Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5S)-rel- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5S)-rel-
- Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, 1-acetate, (1R,2R,5S)-rel-
- iso-Dihydrocarvyl acetate
- DTXSID90176501
- Isodihydrocarveol acetate, (+/-)-
- IP0S4DXY8J
- TUSIZTVSUSBSQI-WCQGTBRESA-N
- Isodihydrocarveol acetate
- (+/-)-Isodihydrocarveol acetate
- Q27280831
- UNII-IP0S4DXY8J
- 220329-20-4
-
- Inchi： 1S/C12H20O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9-,11+,12-/m0/s1
- InChI Key： TUSIZTVSUSBSQI-WCQGTBRESA-N
- SMILES： O(C(C)=O)[C@H]1C[C@H](C(=C)C)CC[C@@H]1C
Computed Properties
- Exact Mass: 196.146
- Monoisotopic Mass: 196.146
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 233
- 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: 3.5
- Topological Polar Surface Area: 26.3?2
Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5S)-rel- Related Literature
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
220329-20-4 (Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, acetate, (1R,2R,5S)-rel-) Related Products
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