Cas no 222547-44-6 (Benzene, [3-(3-cyclohexen-1-yl)propyl]-)
222547-44-6 structure
Product Name:Benzene, [3-(3-cyclohexen-1-yl)propyl]-
CAS No:222547-44-6
MF:C15H20
MW:200.319304466248
CID:1408192
PubChem ID:15881431
Update Time:2025-04-20
Benzene, [3-(3-cyclohexen-1-yl)propyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, [3-(3-cyclohexen-1-yl)propyl]-
- 3-cyclohex-3-en-1-ylpropylbenzene
- 222547-44-6
- [3-(Cyclohex-3-en-1-yl)propyl]benzene
- DTXSID10579095
-
- Inchi: 1S/C15H20/c1-3-8-14(9-4-1)12-7-13-15-10-5-2-6-11-15/h1-5,8-9,15H,6-7,10-13H2
- InChI Key: ZSVQAMKMLDFLKQ-UHFFFAOYSA-N
- SMILES: C1(CC=CCC1)CCCC1C=CC=CC=1
Computed Properties
- Exact Mass: 200.1566
- Monoisotopic Mass: 200.156500638g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 186
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.2
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, [3-(3-cyclohexen-1-yl)propyl]- Related Literature
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Kevin M. Koo,Abu Ali Ibn Sina,Laura G. Carrascosa,Muhammad J. A. Shiddiky Analyst, 2014,139, 6178-6184
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
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