Cas no 5458-64-0 (Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, 1-methylethyl ester)
5458-64-0 structure
Product Name:Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, 1-methylethyl ester
Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, 1-methylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, 1-methylethyl ester
- isopropyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate
- propan-2-yl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
- Chrysanthemic acid, isopropyl ester
- Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 1-methylethyl ester
- Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 1-methylethyl ester (9CI)
- Isopropyl chrysanthemate
- NSC 23746
- propan-2-yl 2,2-dim
- Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, 1-methylethyl ester
- SCHEMBL294024
- Cyclopropanecarboxylic acid,2-dimethyl-3-(2-methyl-1-propenyl)-, 1-methylethyl ester
- NSC23746
- NS00044105
- Cyclopropanecarboxylic acid,2-dimethyl-3-(2-methylpropenyl)-, isopropyl ester
- 5458-64-0
- NSC-23746
- DTXSID20884167
- EINECS 226-722-8
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- Inchi： 1S/C13H22O2/c1-8(2)7-10-11(13(10,5)6)12(14)15-9(3)4/h7,9-11H,1-6H3
- InChI Key： KTDHAAMLKPAGNH-UHFFFAOYSA-N
- SMILES： O(C(C)C)C(C1C(/C=C(\C)/C)C1(C)C)=O
Computed Properties
- Exact Mass: 210.16206
- Monoisotopic Mass: 210.162
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 283
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.6
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.978
- Boiling Point: 240.5°Cat760mmHg
- Flash Point: 90.5°C
- Refractive Index: 1.503
- PSA: 26.3
- LogP: 3.17640
Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(2-methyl-1-propen-1-yl)-, 1-methylethyl ester Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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