Cas no 36911-95-2 (Benz[a]anthracene,8,12-diethyl-)
![Benz[a]anthracene,8,12-diethyl- structure](https://ossimg.kuujia.com/scimg/37000/36911-95-2x500.png)
36911-95-2 structure
Product Name:Benz[a]anthracene,8,12-diethyl-
Benz[a]anthracene,8,12-diethyl- Chemical and Physical Properties
Names and Identifiers
-
- Benz[a]anthracene,8,12-diethyl-
- 8,12-diethylbenzo[a]anthracene
- Benz(a)anthracene, 8,12-diethyl-
- DTXSID60190395
- XDDDKXVKDBLVOT-UHFFFAOYSA-N
- 8,12-Diethylbenz[a]anthracene
- 36911-95-2
- 8,12-Diethylbenz(a)anthracene
- BRN 2274908
-
- Inchi： 1S/C22H20/c1-3-15-9-7-11-20-18(4-2)22-17(14-21(15)20)13-12-16-8-5-6-10-19(16)22/h5-14H,3-4H2,1-2H3
- InChI Key： XDDDKXVKDBLVOT-UHFFFAOYSA-N
- SMILES： C1(CC)C2C=CC=C(CC)C=2C=C2C=CC3C=CC=CC=3C=12
Computed Properties
- Exact Mass: 284.1566
- Monoisotopic Mass: 284.157
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- 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
- XLogP3: 7.7
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 1.0560 (estimate)
- Boiling Point: 493.89°C (rough estimate)
- Flash Point: 238.7°C
- Refractive Index: 1.6770 (estimate)
- PSA: 0
Benz[a]anthracene,8,12-diethyl- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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