Cas no 25849-33-6 (Dibenzo[rst,r's't']phenanthro[10,1,2-cde:9,8,7-c'd'e']dipentaphene-5,14-dione(8CI,9CI))
![Dibenzo[rst,r's't']phenanthro[10,1,2-cde:9,8,7-c'd'e']dipentaphene-5,14-dione(8CI,9CI) structure](https://ossimg.kuujia.com/scimg/26000/25849-33-6x500.png)
25849-33-6 structure
Product Name:Dibenzo[rst,r's't']phenanthro[10,1,2-cde:9,8,7-c'd'e']dipentaphene-5,14-dione(8CI,9CI)
CAS No:25849-33-6
MF:C54H24O2
MW:704.76717376709
CID:282538
PubChem ID:71358963
Update Time:2025-04-19
Dibenzo[rst,r's't']phenanthro[10,1,2-cde:9,8,7-c'd'e']dipentaphene-5,14-dione(8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Dibenzo[rst,r's't']phenanthro[10,1,2-cde:9,8,7-c'd'e']dipentaphene-5,14-dione(8CI,9CI)
- Violongthrone
- CTK1A6508
- Anthra[9,1,2-cde]benzo[rst]dibenzo[1,12:3,4]tetrapheno[9,8,7-klm]pentaphene-5,14-dione
- DTXSID50782864
- 25849-33-6
-
- Inchi： 1S/C54H24O2/c55-53-41-7-3-1-5-25(41)27-9-11-37-33-17-13-29-30-14-18-34-38-12-10-28-26-6-2-4-8-42(26)54(56)44-24-22-40(50(38)52(28)44)36-20-16-32(46(30)48(34)36)31-15-19-35(47(33)45(29)31)39-21-23-43(53)51(27)49(37)39/h1-24H
- InChI Key： HDMPZIHHIVRKBQ-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=CC=2C2C=CC3=C4C=2C1=CC=C4C1=CC=C2C4=CC=C5C6=CC=C7C(C8C=CC=CC=8C8C=CC(=C6C=87)C6C=CC(C7=CC=C3C1=C72)=C4C=65)=O
Computed Properties
- Exact Mass: 704.17772
- Monoisotopic Mass: 704.177630004g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 56
- Rotatable Bond Count: 0
- Complexity: 1540
- 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: 13.2
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
Dibenzo[rst,r's't']phenanthro[10,1,2-cde:9,8,7-c'd'e']dipentaphene-5,14-dione(8CI,9CI) Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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