Cas no 173593-74-3 (Propanedinitrile, (1-methyl-3-oxo-3-phenylpropyl)-)
173593-74-3 structure
Product Name:Propanedinitrile, (1-methyl-3-oxo-3-phenylpropyl)-
CAS No:173593-74-3
MF:C13H12N2O
MW:212.247182846069
CID:1358240
Update Time:2024-08-17
Propanedinitrile, (1-methyl-3-oxo-3-phenylpropyl)- Chemical and Physical Properties
Names and Identifiers
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- Propanedinitrile, (1-methyl-3-oxo-3-phenylpropyl)-
- Propanedinitrile, 2-(1-methyl-3-oxo-3-phenylpropyl)-
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- Inchi： 1S/C13H12N2O/c1-10(12(8-14)9-15)7-13(16)11-5-3-2-4-6-11/h2-6,10,12H,7H2,1H3
- InChI Key： JUKCBLRGDUVDCN-UHFFFAOYSA-N
- SMILES： C(#N)C(C(C)CC(=O)C1=CC=CC=C1)C#N
Computed Properties
- Exact Mass: 212.09506
Experimental Properties
- Density: 1.111±0.06 g/cm3(Predicted)
- Boiling Point: 416.7±35.0 °C(Predicted)
- PSA: 64.65
Propanedinitrile, (1-methyl-3-oxo-3-phenylpropyl)- Related Literature
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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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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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