Cas no 1760-54-9 (1-Cyclohexyl-4-phenylbut-3-en-2-one)
1760-54-9 structure
Product Name:1-Cyclohexyl-4-phenylbut-3-en-2-one
CAS No:1760-54-9
MF:C16H20O
MW:228.329404830933
CID:2782618
PubChem ID:71349946
Update Time:2025-04-21
1-Cyclohexyl-4-phenylbut-3-en-2-one Chemical and Physical Properties
Names and Identifiers
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- DTXSID30775774
- DTXCID60726517
- 1-Cyclohexyl-4-phenylbut-3-en-2-one
- 1760-54-9
-
- Inchi： 1S/C16H20O/c17-16(13-15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1,3-4,7-8,11-12,15H,2,5-6,9-10,13H2
- InChI Key： UZTMNGLSBOBEPG-UHFFFAOYSA-N
- SMILES： O=C(C=CC1C=CC=CC=1)CC1CCCCC1
Computed Properties
- Exact Mass: 228.151415257g/mol
- Monoisotopic Mass: 228.151415257g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 255
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 4.7
- Topological Polar Surface Area: 17.1?2
1-Cyclohexyl-4-phenylbut-3-en-2-one Related Literature
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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