Cas no 26628-88-6 (1H-Indole-3-ethanamine,N,N-diethyl-2-methyl-)
26628-88-6 structure
Product Name:1H-Indole-3-ethanamine,N,N-diethyl-2-methyl-
CAS No:26628-88-6
MF:C15H22N2
MW:230.348583698273
CID:277406
PubChem ID:33561
Update Time:2025-04-19
1H-Indole-3-ethanamine,N,N-diethyl-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-3-ethanamine,N,N-diethyl-2-methyl-
- N,N-diethyl-2-(2-methyl-1H-indol-3-yl)ethanamine
- SSF4F77CV3
- 2-ME-DET
- SCHEMBL20970934
- 3-(2-(Diethylamino)ethyl)-2-methylindole
- Q4596894
- N,N-Diethyl-2-methyl-1H-indole-3-ethanamine
- DTXSID30181174
- DIETHYL(2-(2-METHYL-1H-INDOL-3-YL)ETHYL)AMINE
- BRN 0166959
- INDOLE, 3-(2-(DIETHYLAMINO)ETHYL)-2-METHYL-
- UNII-SSF4F77CV3
- 5-22-10-00158 (Beilstein Handbook Reference)
- 26628-88-6
-
- Inchi： 1S/C15H22N2/c1-4-17(5-2)11-10-13-12(3)16-15-9-7-6-8-14(13)15/h6-9,16H,4-5,10-11H2,1-3H3
- InChI Key： VVUATPWGKMGHGM-UHFFFAOYSA-N
- SMILES： N(CC)(CC)CCC1=C(C)NC2C=CC=CC1=2
Computed Properties
- Exact Mass: 230.17846
- Monoisotopic Mass: 230.178299
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 225
- 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
- Topological Polar Surface Area: 19
- XLogP3: 3.5
Experimental Properties
- Density: 1.027
- Boiling Point: 374°Cat760mmHg
- Flash Point: 180°C
- Refractive Index: 1.585
- PSA: 19.03
1H-Indole-3-ethanamine,N,N-diethyl-2-methyl- Related Literature
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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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
-
J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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