Cas no 1421-80-3 (Benzo[k]benz[a]anthracen-3-ol)
![Benzo[k]benz[a]anthracen-3-ol structure](https://ossimg.kuujia.com/scimg/1500/1421-80-3x500.png)
Benzo[k]benz[a]anthracen-3-ol structure
Product Name:Benzo[k]benz[a]anthracen-3-ol
Benzo[k]benz[a]anthracen-3-ol Chemical and Physical Properties
Names and Identifiers
-
- Benzo[k]benz[a]anthracen-3-ol
- 3-Hydroxydibenz(A,H)anthracene
- Dibenz(a,h)anthracen-3-ol
- DTXSID20931342
- 1421-80-3
- Benzo[k]tetraphen-3-ol
- 3-hydroxydibenzo[a,h]anthracene
-
- Inchi： 1S/C22H14O/c23-18-9-10-20-15(11-18)7-8-17-12-21-16(13-22(17)20)6-5-14-3-1-2-4-19(14)21/h1-13,23H
- InChI Key： NDIDAMUPHMYPTC-UHFFFAOYSA-N
- SMILES： OC1C=CC2=C(C=1)C=CC1=CC3C4C=CC=CC=4C=CC=3C=C12
Computed Properties
- Exact Mass: 294.10452
- Monoisotopic Mass: 294.104465
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 23
- Rotatable Bond Count: 0
- Complexity: 432
- 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: 6.4
- Topological Polar Surface Area: 20.2
Experimental Properties
- Density: 1.312
- Boiling Point: 581.7°C at 760 mmHg
- Flash Point: 276°C
- Refractive Index: 1.841
- PSA: 20.23
Benzo[k]benz[a]anthracen-3-ol Related Literature
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Danlei Xiang Nanoscale, 2021,13, 5497-5506
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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