Cas no 70644-19-8 (9-methylbenzo[pqr]tetraphene)
![9-methylbenzo[pqr]tetraphene structure](https://ossimg.kuujia.com/scimg/71000/70644-19-8x500.png)
9-methylbenzo[pqr]tetraphene structure
Product Name:9-methylbenzo[pqr]tetraphene
9-methylbenzo[pqr]tetraphene Chemical and Physical Properties
Names and Identifiers
-
- 9-methylbenzo[pqr]tetraphene
- benzo[a]pyrene, 9-methyl-
- 9-Methylbenzo[a]pyrene
- DB-197641
- CCRIS 2442
- DTXSID20220925
- BRN 2370818
- BENZO(a)PYRENE, 9-METHYL-
- 9-METHYLBENZO[A]PYRENE STANDARD SOLUTION
- 5LE42ZQ3QS
- 70644-19-8
- 9-Methylbenzo(a)pyrene
-
- Inchi： 1S/C21H14/c1-13-5-6-16-12-17-8-7-14-3-2-4-15-9-10-18(19(16)11-13)21(17)20(14)15/h2-12H,1H3
- InChI Key： PPGFLJQLUCRDDM-UHFFFAOYSA-N
- SMILES： C12C3C=CC4=CC=CC(=CC=C1C1C=C(C)C=CC=1C=3)C=24
Computed Properties
- Exact Mass: 266.10962
- Monoisotopic Mass: 266.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 21
- Rotatable Bond Count: 0
- Complexity: 399
- 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: 7
- Topological Polar Surface Area: 0A^2
Experimental Properties
- Density: 1.254
- Boiling Point: 479.4°C at 760 mmHg
- Flash Point: 236.7°C
- Refractive Index: 1.853
- PSA: 0
9-methylbenzo[pqr]tetraphene Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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