Cas no 29036-25-7 (1H-Indene, methyl-)
1H-Indene, methyl- structure
Product Name:1H-Indene, methyl-
1H-Indene, methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indene, methyl-
- 1-methyl-1H-indene
- Methyl-1H-indene
- Methylindene
- 29036-25-7
- AKOS004907874
- 1-METHYL INDENE
- EINECS 249-382-2
- Indene, 1-methyl-
- METHYL INDENE
- .alpha.-Methylindene
- DTXSID50865464
- InChI=1/C10H10/c1-8-6-7-9-4-2-3-5-10(8)9/h2-8H,1H
- A838817
- 1-METHYLINDENE
- MFCD00039585
- FT-0632918
- 767-59-9
- NSC 38857
- 1-Methyl-1H-indene #
- NS00042549
- A1-00157
- XEL55RNS7J
- 1-METHYLINDENE, (+/-)-
- Q27293807
- 1H-Indene, 1-methyl-
- EINECS 212-185-7
- NSC38857
- NSC-38857
- UNII-XEL55RNS7J
-
- Inchi： 1S/C10H10/c1-8-6-7-9-4-2-3-5-10(8)9/h2-8H,1H3
- InChI Key： LRTOHSLOFCWHRF-UHFFFAOYSA-N
- SMILES： C1(C)C=CC2C=CC=CC1=2
Computed Properties
- Exact Mass: 130.0783
- Monoisotopic Mass: 130.078
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 146
- 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
- Topological Polar Surface Area: 0A^2
- XLogP3: 3
Experimental Properties
- Density: 0.987
- Boiling Point: 199 °C at 760 mmHg
- Flash Point: 76.7 °C
- Refractive Index: 1.561
- PSA: 0
- LogP: 2.81690
1H-Indene, methyl- Related Literature
-
Tao Yang,Dorian S. N. Parker,Beni B. Dangi,Ralf I. Kaiser,Alexander M. Mebel Phys. Chem. Chem. Phys. 2015 17 10510
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2. Five vs. six membered-ring PAH products from reaction of o-methylphenyl radical and two C3H4 isomersOisin J. Shiels,Matthew B. Prendergast,John D. Savee,David L. Osborn,Craig A. Taatjes,Stephen J. Blanksby,Gabriel da Silva,Adam J. Trevitt Phys. Chem. Chem. Phys. 2021 23 14913
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3. o-Quinonoid compounds. Part 15. Rapid formyl migration in 1-formylindenes; evidence for concertedness and exclusive 1,5-sigmatropyDouglas J. Field,David W. Jones J. Chem. Soc. Perkin Trans. 1 1979 1273
-
Amir Golan,Musahid Ahmed,Alexander M. Mebel,Ralf I. Kaiser Phys. Chem. Chem. Phys. 2013 15 341
-
5. Primary 2H kinetic isotope effects in the base-catalysed 1,3-prototropic rearrangement of 1-methylindene and 1,3-dimethylindeneAnita Hussénius,Olle Matsson,G?ran Bergson J. Chem. Soc. Perkin Trans. 2 1989 851
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