Cas no 59019-88-4 (2-Butanone, 4-[2-methyl-5-(1-methylethyl)cyclopentyl]-)
59019-88-4 structure
Product Name:2-Butanone, 4-[2-methyl-5-(1-methylethyl)cyclopentyl]-
CAS No:59019-88-4
MF:C13H24O
MW:196.329064369202
CID:340159
PubChem ID:71443229
Update Time:2025-04-19
2-Butanone, 4-[2-methyl-5-(1-methylethyl)cyclopentyl]- Chemical and Physical Properties
Names and Identifiers
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- 2-Butanone, 4-[2-methyl-5-(1-methylethyl)cyclopentyl]-
- 4-(2-methyl-5-propan-2-ylcyclopentyl)butan-2-one
- 59019-88-4
- 4-[2-Methyl-5-(propan-2-yl)cyclopentyl]butan-2-one
- DTXSID40852060
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- Inchi: 1S/C13H24O/c1-9(2)12-7-5-10(3)13(12)8-6-11(4)14/h9-10,12-13H,5-8H2,1-4H3
- InChI Key: LFEXTXOTFJTKGO-UHFFFAOYSA-N
- SMILES: O=C(C)CCC1C(C)CCC1C(C)C
Computed Properties
- Exact Mass: 196.18282
- Monoisotopic Mass: 196.182715385g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 195
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.7
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
2-Butanone, 4-[2-methyl-5-(1-methylethyl)cyclopentyl]- Related Literature
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1. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
59019-88-4 (2-Butanone, 4-[2-methyl-5-(1-methylethyl)cyclopentyl]-) Related Products
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