Cas no 21493-94-7 (Methanone, (5-methyl-2-furanyl)phenyl-)
21493-94-7 structure
Product Name:Methanone, (5-methyl-2-furanyl)phenyl-
CAS No:21493-94-7
MF:C12H10O2
MW:186.206603527069
CID:1401498
PubChem ID:11679940
Update Time:2025-04-20
Methanone, (5-methyl-2-furanyl)phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (5-methyl-2-furanyl)phenyl-
- (5-methylfuran-2-yl)-phenylmethanone
- (5-Methyl-2-furanyl)phenylmethanone
- 21493-94-7
- DTXSID60470482
- DRRGJRUNNNIEFT-UHFFFAOYSA-N
- (5-methylfuran-2-yl)(phenyl)methanone
- phenyl 5-methyl-2-furyl ketone
- DB-146025
- SCHEMBL7386275
-
- Inchi： 1S/C12H10O2/c1-9-7-8-11(14-9)12(13)10-5-3-2-4-6-10/h2-8H,1H3
- InChI Key： DRRGJRUNNNIEFT-UHFFFAOYSA-N
- SMILES： O1C(C)=CC=C1C(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 186.0681
- Monoisotopic Mass: 186.068079557g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 206
- 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: 3.1
- Topological Polar Surface Area: 30.2?2
Experimental Properties
- PSA: 30.21
Methanone, (5-methyl-2-furanyl)phenyl- Related Literature
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Wenjie Zhao,Hua Hou,Yuchun Jin,Zhixiang Zeng,Xuedong Wu,Qunji Xue RSC Adv., 2014,4, 60307-60315
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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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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
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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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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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