Cas no 21248-02-2 (benzo[pqr]tetraphene-6-carbonitrile)
![benzo[pqr]tetraphene-6-carbonitrile structure](https://ossimg.kuujia.com/scimg/21500/21248-02-2x500.png)
21248-02-2 structure
Product Name:benzo[pqr]tetraphene-6-carbonitrile
CAS No:21248-02-2
MF:C21H11N
MW:277.318744897842
CID:1399808
PubChem ID:186057
Update Time:2025-04-20
benzo[pqr]tetraphene-6-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- benzo[pqr]tetraphene-6-carbonitrile
- benzo[b]pyrene-6-carbonitrile
- Benzo(a)pyrene-6-carbonitrile
- benzo[a]pyrene-6-carbonitrile
- Benzo(pqr)tetraphene-6-carbonitrile
- 21248-02-2
- DTXSID10175495
-
- Inchi： 1S/C21H11N/c22-12-19-16-7-2-1-6-15(16)17-10-8-13-4-3-5-14-9-11-18(19)21(17)20(13)14/h1-11H
- InChI Key： RCCVMKDMDWYOHS-UHFFFAOYSA-N
- SMILES： N#CC1C2C=CC=CC=2C2=CC=C3C=CC=C4C=CC=1C2=C34
Computed Properties
- Exact Mass: 277.08923
- Monoisotopic Mass: 277.089149
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 22
- Rotatable Bond Count: 0
- Complexity: 487
- 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: 6.1
- Topological Polar Surface Area: 23.8
Experimental Properties
- Density: 1.32
- Boiling Point: 534.3°C at 760 mmHg
- Flash Point: 279.2°C
- Refractive Index: 1.856
- PSA: 23.79
benzo[pqr]tetraphene-6-carbonitrile Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
21248-02-2 (benzo[pqr]tetraphene-6-carbonitrile) Related Products
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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