Cas no 5192-14-3 (1H-Indole,3-(2-phenylethyl)-)
1H-Indole,3-(2-phenylethyl)- structure
Product Name:1H-Indole,3-(2-phenylethyl)-
1H-Indole,3-(2-phenylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole,3-(2-phenylethyl)-
- 3-(2-phenylethyl)-1H-indole
- 3-phenethyl-1H-indole
- AC1L870Z
- NSC405964
- NSC-405964
- SureCN8524609
- 5192-14-3
- DTXSID80324175
- 3-phenylethylindole
- SCHEMBL8524609
-
- Inchi： 1S/C16H15N/c1-2-6-13(7-3-1)10-11-14-12-17-16-9-5-4-8-15(14)16/h1-9,12,17H,10-11H2
- InChI Key： CEGFYUILHMIKCP-UHFFFAOYSA-N
- SMILES： N1C=C(C2C=CC=CC1=2)CCC1C=CC=CC=1
Computed Properties
- Exact Mass: 221.12055
- Monoisotopic Mass: 221.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 232
- 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: 4.4
- Topological Polar Surface Area: 15.8?2
Experimental Properties
- Density: 1.132
- Boiling Point: 375.8°Cat760mmHg
- Flash Point: 163.5°C
- Refractive Index: 1.665
- PSA: 15.79
- LogP: 3.95310
1H-Indole,3-(2-phenylethyl)- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
5192-14-3 (1H-Indole,3-(2-phenylethyl)-) Related Products
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