Cas no 111238-21-2 (6-methyl-1,2-dihydrocyclopenta[ij]tetraphen-9-ol)
![6-methyl-1,2-dihydrocyclopenta[ij]tetraphen-9-ol structure](https://ossimg.kuujia.com/scimg/111500/111238-21-2x500.png)
111238-21-2 structure
Product Name:6-methyl-1,2-dihydrocyclopenta[ij]tetraphen-9-ol
CAS No:111238-21-2
MF:C21H16O
MW:284.351145744324
CID:1197263
PubChem ID:183234
Update Time:2025-04-20
6-methyl-1,2-dihydrocyclopenta[ij]tetraphen-9-ol Chemical and Physical Properties
Names and Identifiers
-
- 6-methyl-1,2-dihydrocyclopenta[ij]tetraphen-9-ol
- 6-methyl-1,2-dihydrobenzo[j]aceanthrylen-9-ol
- 111238-21-2
- DTXSID80149562
- Benzo(j)aceanthrylen-9-ol, 1,2-dihydro-6-methyl-
- 6-Methyl-1,2-dihydrobenzo(j)aceanthrylen-9-ol
-
- Inchi： 1S/C21H16O/c1-12-16-4-2-3-13-5-8-19(21(13)16)18-9-6-14-11-15(22)7-10-17(14)20(12)18/h2-4,6-7,9-11,22H,5,8H2,1H3
- InChI Key： UWVOYPJPZQNKCJ-UHFFFAOYSA-N
- SMILES： OC1C=CC2=C(C=1)C=CC1=C2C(C)=C2C=CC=C3CCC1=C32
Computed Properties
- Exact Mass: 284.12018
- Monoisotopic Mass: 284.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 22
- 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
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Density: 1.305
- Boiling Point: 562.8°C at 760 mmHg
- Flash Point: 267.8°C
- Refractive Index: 1.81
- PSA: 20.23
6-methyl-1,2-dihydrocyclopenta[ij]tetraphen-9-ol Related Literature
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Riccardo Spezia,Stefan Knecht,Benedetta Mennucci Phys. Chem. Chem. Phys., 2017,19, 17156-17166
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
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