Chem
J-GLOBAL ID：201707007038168409   Nikkaji number：J3.666.851B

2,8,14-Tris(2,6-dimethylphenyl)hexabenzo[bc,ef,hi,kl,no,qr]coronene

2,8,14-トリス(2,6-ジメチルフェニル)ヘキサベンゾ[bc,ef,hi,kl,no,qr]コロネン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C66H42
Molecular formula furigana： C66-H42
Molecular weight： 835.062
InChI： InChI=1S/C66H42/c1-31-13-7-14-32(2)52(31)37-25-46-40-19-10-21-42-48-27-38(53-33(3)15-8-16-34(53)4)29-50-44-23-12-24-45-51-30-39(54-35(5)17-9-18-36(54)6)28-49-43-22-11-20-41-47(26-37)58(46)64-61(55(40)42)65(59(48)50)63(57(44)45)66(60(49)51)62(64)56(41)43/h7-30H,1-6H3
InChI key： HINUCJFBUIYPKO-UHFFFAOYSA-N
SMILES： Cc1cccc(C)c1c1cc2c3cccc4c5cc(cc6c7cccc8c9cc(cc%10c%11cccc%12c(c1)c2c1c(c34)c(c56)c(c78)c(c9%10)c1c%11%12)c1c(C)cccc1C)c1c(C)cccc1C
Systematic name  (3)：
  • 2,8,14-トリス(2,6-ジメチルフェニル)ヘキサベンゾ[bc,ef,hi,kl,no,qr]コロネン
  • 6,20,34-トリス(2,6-ジメチルフェニル)トリデカシクロ[28.12.0.02,15.03,8.04,41.09,14.013,18.016,29.017,22.023,28.027,32.031,36.037,42]ドテトラコンタ-1(42),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40-ヘンイコサエン
  • 6,20,34-tris(2,6-dimethylphenyl)tridecacyclo[28.12.0.02,15.03,8.04,41.09,14.013,18.016,29.017,22.023,28.027,32.031,36.037,42]dotetraconta-1(42),2,4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40-henicosaene
Other name (1)：
  • 2,8,14-Tris(2,6-dimethylphenyl)hexabenzo[bc,ef,hi,kl,no,qr]coronene
Thsaurus map：
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