Cas no 13724-00-0 (2,2-dimethyl-3-(2-oxocyclohexyl)-3-phenylpropanoic acid)
13724-00-0 structure
Product Name:2,2-dimethyl-3-(2-oxocyclohexyl)-3-phenylpropanoic acid
CAS No:13724-00-0
MF:C17H22O3
MW:274.354785442352
CID:1241816
Update Time:2023-04-03
2,2-dimethyl-3-(2-oxocyclohexyl)-3-phenylpropanoic acid Chemical and Physical Properties
Names and Identifiers
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- Cyclohexanepropionic Acid, .α.,.α.-dimethyl-2-oxo-.β.-phenyl- (en)
- 2,2-dimethyl-3-(2-oxocyclohexyl)-3-phenylpropanoic acid
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- Inchi： 1S/C17H22O3/c1-17(2,16(19)20)15(12-8-4-3-5-9-12)13-10-6-7-11-14(13)18/h3-5,8-9,13,15H,6-7,10-11H2,1-2H3,(H,19,20)
- InChI Key： AJVFOGGGBHLTOF-UHFFFAOYSA-N
- SMILES： C(O)(=O)C(C)(C)C(C1CCCCC1=O)C1=CC=CC=C1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
2,2-dimethyl-3-(2-oxocyclohexyl)-3-phenylpropanoic acid Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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