Cas no 5779-79-3 (Cyclopenta[de]benz[a]anthracene,4,5-dihydro-)
![Cyclopenta[de]benz[a]anthracene,4,5-dihydro- structure](https://ossimg.kuujia.com/scimg/6000/5779-79-3x500.png)
5779-79-3 structure
Product Name:Cyclopenta[de]benz[a]anthracene,4,5-dihydro-
Cyclopenta[de]benz[a]anthracene,4,5-dihydro- Chemical and Physical Properties
Names and Identifiers
-
- Cyclopenta[de]benz[a]anthracene,4,5-dihydro-
- 4,5-DIHYDRO-BENZ(K)ACEPHENANTHRYLENE
- Acenaphthanthracene
- 3,4'-Ace-1,2-benzanthracene
- Benz[k]acephenanthrene
- Benz[k]acephenanthrylene,4,5-dihydro- (6CI,8CI,9CI)
- CYCLOPENTA(DE)BENZ(A)ANTHRACENE, 4,5-DIHYDRO-
- Benz(k)acephenanthrylene, 4,5-dihydro-
- 4,5-DIHYDROBENZ(K)ACEPHENANTHRYLENE
- 3:4-Dimethylene-1:2-benzanthracene
- 3,4-DIMETHYLENE-1,2-BENZANTHRACENE
- Q27276354
- UNII-DEW3G130KU
- DEW3G130KU
- Acenaphthanthracen
- Benz(k)acephenanthrene
- BRN 3274312
- 5779-79-3
- DTXSID40206483
-
- Inchi： 1S/C20H14/c1-2-5-15-12-19-17(10-14(15)4-1)11-16-9-8-13-6-3-7-18(19)20(13)16/h1-7,10-12H,8-9H2
- InChI Key： PMNATJJZOUNELG-UHFFFAOYSA-N
- SMILES： C12C3C=CC=C1CCC=2C=C1C=C2C=CC=CC2=CC=31
Computed Properties
- Exact Mass: 254.109550447g/mol
- Monoisotopic Mass: 254.109550447g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 372
- 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: 5.7
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 1.1180 (estimate)
- Boiling Point: 332.54°C (rough estimate)
- Refractive Index: 1.7040 (estimate)
Cyclopenta[de]benz[a]anthracene,4,5-dihydro- Security Information
- Safety Term：Questionable carcinogen with experimental tumorigenic data. When heated to decomposition it emits acrid smoke and irritating fumes.
Cyclopenta[de]benz[a]anthracene,4,5-dihydro- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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