Cas no 119058-72-9 ((1,2,2-trimethylcyclohexyl) 2-methylprop-2-enoate)
119058-72-9 structure
Product Name:(1,2,2-trimethylcyclohexyl) 2-methylprop-2-enoate
CAS No:119058-72-9
MF:C13H22O2
MW:210.312584400177
CID:2616167
PubChem ID:21863437
Update Time:2025-04-21
(1,2,2-trimethylcyclohexyl) 2-methylprop-2-enoate Chemical and Physical Properties
Names and Identifiers
-
- (1,2,2-trimethylcyclohexyl) 2-methylprop-2-enoate
- APAUNQLFVGBQQW-UHFFFAOYSA-N
- DTXSID20618989
- 119058-72-9
- trimethylcyclohexyl methacrylate
- 1,2,2-Trimethylcyclohexyl 2-methylprop-2-enoate
- SCHEMBL236409
-
- Inchi： 1S/C13H22O2/c1-10(2)11(14)15-13(5)9-7-6-8-12(13,3)4/h1,6-9H2,2-5H3
- InChI Key： APAUNQLFVGBQQW-UHFFFAOYSA-N
- SMILES： O(C(C(=C)C)=O)C1(C)CCCCC1(C)C
Computed Properties
- Exact Mass: 210.161979940Da
- Monoisotopic Mass: 210.161979940Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 278
- 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: 3.9
- Topological Polar Surface Area: 26.3?2
(1,2,2-trimethylcyclohexyl) 2-methylprop-2-enoate Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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