Cas no 61545-39-9 (1H-Indole, 6-methyl-4-(oxiranylmethoxy)-)
61545-39-9 structure
Product Name:1H-Indole, 6-methyl-4-(oxiranylmethoxy)-
CAS No:61545-39-9
MF:C12H13NO2
MW:203.237123250961
CID:475468
PubChem ID:20527563
Update Time:2025-04-19
1H-Indole, 6-methyl-4-(oxiranylmethoxy)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Indole, 6-methyl-4-(oxiranylmethoxy)-
- 6-methyl-4-(oxiran-2-ylmethoxy)-1H-indole
- DTXSID40608387
- 61545-39-9
- SCHEMBL10593413
- 6-Methyl-4-[(oxiran-2-yl)methoxy]-1H-indole
-
- Inchi： 1S/C12H13NO2/c1-8-4-11-10(2-3-13-11)12(5-8)15-7-9-6-14-9/h2-5,9,13H,6-7H2,1H3
- InChI Key： BKAHBWRBBQERJX-UHFFFAOYSA-N
- SMILES： O1CC1COC1=CC(C)=CC2=C1C=CN2
Computed Properties
- Exact Mass: 203.09469
- Monoisotopic Mass: 203.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 234
- 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: 2.1
- Topological Polar Surface Area: 37.6?2
Experimental Properties
- PSA: 37.55
1H-Indole, 6-methyl-4-(oxiranylmethoxy)- Related Literature
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
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2. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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