Cas no 170653-86-8 (Aceanthrylene,6-methyl-)
Aceanthrylene,6-methyl- structure
Product Name:Aceanthrylene,6-methyl-
CAS No:170653-86-8
MF:C17H12
MW:216.277184486389
CID:228145
PubChem ID:3025911
Update Time:2025-04-19
Aceanthrylene,6-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Aceanthrylene,6-methyl-
- 6-Methylaceanthrylene
- DTXSID80168915
- 170653-86-8
-
- Inchi： 1S/C17H12/c1-11-13-6-2-3-7-15(13)16-10-9-12-5-4-8-14(11)17(12)16/h2-10H,1H3
- InChI Key： XIHBIKWZKWLRQI-UHFFFAOYSA-N
- SMILES： C12C3=CC=CC1=C(C)C1C=CC=CC=1C=2C=C3
Computed Properties
- Exact Mass: 216.09396
- Monoisotopic Mass: 216.094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 329
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 5.3
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 1.211
- Boiling Point: 418.3°Cat760mmHg
- Flash Point: 197.3°C
- Refractive Index: 1.766
- PSA: 0
Aceanthrylene,6-methyl- Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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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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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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