Cas no 74192-50-0 (1,6-diethoxybenzo[pqr]tetraphene)
74192-50-0 structure
Product Name:1,6-diethoxybenzo[pqr]tetraphene
CAS No:74192-50-0
MF:C24H20O2
MW:340.414406776428
CID:1766256
PubChem ID:186889
Update Time:2025-04-21
1,6-diethoxybenzo[pqr]tetraphene Chemical and Physical Properties
Names and Identifiers
-
- 1,6-diethoxybenzo[pqr]tetraphene
- benzo[a]pyrene, 1,6-diethoxy-
- 1,6-diethoxybenzo[a]pyrene
- 1,6-Diethoxybenzo(a)pyrene
- CHEMBL171420
- DTXSID30225163
- 74192-50-0
- 1,6-Diethoxy-benzo[def]chrysene
- Benzo(a)pyrene, 1,6-diethoxy-
-
- Inchi: 1S/C24H20O2/c1-3-25-21-14-10-15-9-11-20-23-17(12-13-19(21)22(15)23)16-7-5-6-8-18(16)24(20)26-4-2/h5-14H,3-4H2,1-2H3
- InChI Key: IFBRNTLNDNNYJY-UHFFFAOYSA-N
- SMILES: O(CC)C1C2C=CC=CC=2C2=CC=C3C(=CC=C4C=CC=1C2=C34)OCC
Computed Properties
- Exact Mass: 340.146329876g/mol
- Monoisotopic Mass: 340.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 26
- Rotatable Bond Count: 4
- Complexity: 491
- 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: 18.5?2
1,6-diethoxybenzo[pqr]tetraphene Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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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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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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