Cas no 61777-15-9 (Benzene, 1,1'-(1,3-dimethyl-2-butene-1,4-diyl)bis-)
61777-15-9 structure
Product Name:Benzene, 1,1'-(1,3-dimethyl-2-butene-1,4-diyl)bis-
CAS No:61777-15-9
MF:C18H20
MW:236.351405143738
CID:466514
PubChem ID:54174856
Update Time:2025-04-19
Benzene, 1,1'-(1,3-dimethyl-2-butene-1,4-diyl)bis- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,1'-(1,3-dimethyl-2-butene-1,4-diyl)bis-
- (2-methyl-4-phenylpent-2-enyl)benzene
- 1,1'-(2-Methylpent-2-ene-1,4-diyl)dibenzene
- 61777-15-9
- DTXSID80709529
-
- Inchi： 1S/C18H20/c1-15(14-17-9-5-3-6-10-17)13-16(2)18-11-7-4-8-12-18/h3-13,16H,14H2,1-2H3
- InChI Key： OXOONLCHLVIFPT-UHFFFAOYSA-N
- SMILES： C(C)(C1C=CC=CC=1)C=C(C)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 236.1566
- Monoisotopic Mass: 236.156500638g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 251
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 5.7
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, 1,1'-(1,3-dimethyl-2-butene-1,4-diyl)bis- Related Literature
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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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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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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