Cas no 294210-46-1 (Cyclohexanecarboxaldehyde,3,4-dimethyl -2-oxo- (9ci))
294210-46-1 structure
Product Name:Cyclohexanecarboxaldehyde,3,4-dimethyl -2-oxo- (9ci)
CAS No:294210-46-1
MF:C9H14O2
MW:154.206263065338
CID:2188744
Update Time:2025-03-29
Cyclohexanecarboxaldehyde,3,4-dimethyl -2-oxo- (9ci) Chemical and Physical Properties
Names and Identifiers
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- Cyclohexanecarboxaldehyde,3,4-dimethyl -2-oxo- (9ci)
- Cyclohexanecarboxaldehyde, 3,4-dimethyl-2-oxo- (9CI)
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- Inchi： 1S/C9H14O2/c1-6-3-4-8(5-10)9(11)7(6)2/h5-8H,3-4H2,1-2H3
- InChI Key： CJNOWQDTLCUALG-UHFFFAOYSA-N
- SMILES： C1(C=O)CCC(C)C(C)C1=O
Computed Properties
- Exact Mass: 154.099
- Monoisotopic Mass: 154.099
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 174
- 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
- Topological Polar Surface Area: 34.1A^2
Cyclohexanecarboxaldehyde,3,4-dimethyl -2-oxo- (9ci) Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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