Cas no 63041-88-3 (Brn 3134754)
Brn 3134754 structure
Product Name:Brn 3134754
CAS No:63041-88-3
MF:C20H14
MW:254.325165271759
CID:1650624
PubChem ID:112985
Update Time:2025-04-21
Brn 3134754 Chemical and Physical Properties
Names and Identifiers
-
- BRN 3134754
- 6-methyl-11H-cyclopenta[pqr]tetraphene
- 10-Methyl-1',9-methylene-1,2-benzanthracene
- 11H-Benz(bc)aceanthrylene, 6-methyl-
- 6-Methyl-11H-benz[bc]aceanthrylen
- AC1L3CEC
- LS-24791
- 6-methyl-11H-benz<
- bc>
- aceanthrylene
- 6-Methyl-11H-benz[bc]aceanthrylene
- 6-methyl-11H-benz<bc>aceanthrylene
- DTXSID00212368
- DB-219888
- 63041-88-3
- Brn 3134754
-
- Inchi： 1S/C20H14/c1-12-15-7-2-3-8-17(15)18-11-14-6-4-5-13-9-10-16(12)20(18)19(13)14/h2-10H,11H2,1H3
- InChI Key： IJAOHUABITVDOH-UHFFFAOYSA-N
- SMILES： C12C3C=CC4=CC=CC(CC=1C1C=CC=CC=1C=3C)=C24
Computed Properties
- Exact Mass: 254.10962
- 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: 386
- 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: 0?2
Experimental Properties
- Density: 1.1180 (estimate)
- Boiling Point: 332.54°C (rough estimate)
- Refractive Index: 1.7040 (estimate)
- PSA: 0
Brn 3134754 Related Literature
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Eunkyung Choi,Minjoo Ryu,Haeri Lee,Ok-Sang Jung Dalton Trans., 2017,46, 4595-4601
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