Cas no 87729-00-8 (Benzene, 1-ethenyl-2-(1-phenylethenyl)-)
87729-00-8 structure
Product Name:Benzene, 1-ethenyl-2-(1-phenylethenyl)-
CAS No:87729-00-8
MF:C16H14
MW:206.282364368439
CID:652996
PubChem ID:13218017
Update Time:2025-04-19
Benzene, 1-ethenyl-2-(1-phenylethenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-ethenyl-2-(1-phenylethenyl)-
- 1-ethenyl-2-(1-phenylethenyl)benzene
- DTXSID60529141
- 87729-00-8
-
- Inchi： 1S/C16H14/c1-3-14-9-7-8-12-16(14)13(2)15-10-5-4-6-11-15/h3-12H,1-2H2
- InChI Key： IXLQWRLPKWWTCF-UHFFFAOYSA-N
- SMILES： C1(C=CC=CC=1C=C)C(=C)C1C=CC=CC=1
Computed Properties
- Exact Mass: 206.109550447g/mol
- Monoisotopic Mass: 206.109550447g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 245
- 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: 5.4
- Topological Polar Surface Area: 0?2
Benzene, 1-ethenyl-2-(1-phenylethenyl)- Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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