Cas no 56624-91-0 (ACETOPHENONE, [METHYL-14C])
ACETOPHENONE, [METHYL-14C] structure
Product Name:ACETOPHENONE, [METHYL-14C]
CAS No:56624-91-0
MF:C8H8O
MW:122.141063690186
CID:945693
PubChem ID:12196848
Update Time:2025-04-19
ACETOPHENONE, [METHYL-14C] Chemical and Physical Properties
Names and Identifiers
-
- ACETOPHENONE, [METHYL-14C]
- [2-13C]propene
- < 2-13C> propene
- < 2-14C> -Acetophenon
- 1-phenyl-[2-14C]ethanone
- 2-13C-prop-1-ene
- 487015_ALDRICH
- I14-46203
- propene-2-(13)C
- Propene-2-13C
- Propene-2-C-13
- Propylene-2-13C
- 56624-91-0
-
- Inchi: 1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3/i1+2
- InChI Key: KWOLFJPFCHCOCG-NJFSPNSNSA-N
- SMILES: O=C([14CH3])C1C=CC=CC=1
Computed Properties
- Exact Mass: 122.06075686g/mol
- Monoisotopic Mass: 122.06075686g/mol
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 101
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 17.1?2
ACETOPHENONE, [METHYL-14C] Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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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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