Cas no 3536-29-6 (Benzenepropanol, b-phenyl-)
Benzenepropanol, b-phenyl- structure
Product Name:Benzenepropanol, b-phenyl-
Benzenepropanol, b-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanol, b-phenyl-
- 2,3-diphenylpropanol
- 2,3-diphenylpropan-1-ol
- NS00048377
- 3536-29-6
- DTXSID80871033
- SCHEMBL597894
- AKOS015157985
- EINECS 222-572-2
-
- Inchi： 1S/C15H16O/c16-12-15(14-9-5-2-6-10-14)11-13-7-3-1-4-8-13/h1-10,15-16H,11-12H2
- InChI Key： IITXBLBBWAPMPY-UHFFFAOYSA-N
- SMILES： OCC(C1C=CC=CC=1)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 212.12018
- Monoisotopic Mass: 212.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 178
- 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: 3.2
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Density: 1.0585
- Melting Point: 51°C
- Boiling Point: 310°C (estimate)
- Flash Point: 134.4°C
- Refractive Index: 1.5742 (estimate)
- PSA: 20.23
Benzenepropanol, b-phenyl- Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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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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