Cas no 7428-83-3 (6-aminobenzo(a)pyrene)
6-aminobenzo(a)pyrene structure
Product Name:6-aminobenzo(a)pyrene
6-aminobenzo(a)pyrene Chemical and Physical Properties
Names and Identifiers
-
- 6-aminobenzo(a)pyrene
- 6-AMINOBENZO[A]PYRENE
- 6-Aminobenzo[a]pyreneneat
- benzo[b]pyren-6-amine
- CZURZERLMHKKGV-UHFFFAOYSA-N
- 6-Benzo[a]pyrenamine
- BENZO(a)PYREN-6-AMINE
- SCHEMBL4916286
- 7428-83-3
- DTXSID60225297
- 3-12-00-03404 (Beilstein Handbook Reference)
- BRN 2982332
- Benzo[a]pyren-6-amine
- DB-219724
- Benzo[pqr]tetraphen-6-amine
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- Inchi： 1S/C20H13N/c21-20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-11H,21H2
- InChI Key： CZURZERLMHKKGV-UHFFFAOYSA-N
- SMILES： NC1C2C=CC=CC=2C2=CC=C3C=CC=C4C=CC=1C2=C34
Computed Properties
- Exact Mass: 267.10489
- Monoisotopic Mass: 267.104799419g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 21
- Rotatable Bond Count: 0
- Complexity: 405
- 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: 5.6
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.02
6-aminobenzo(a)pyrene Related Literature
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
7428-83-3 (6-aminobenzo(a)pyrene) Related Products
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- 17075-03-5(4-Aminopyrene)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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