Cas no 89963-32-6 (Benzopyrene, butoxy-)
Benzopyrene, butoxy- structure
Product Name:Benzopyrene, butoxy-
CAS No:89963-32-6
MF:C24H20O
MW:324.415006637573
CID:584706
PubChem ID:71327014
Update Time:2025-04-19
Benzopyrene, butoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzopyrene, butoxy-
- 8-butoxybenzo[e]pyrene
- 1-Butoxybenzo[e]pyrene
- 89963-32-6
- DTXSID10756127
-
- Inchi： 1S/C24H20O/c1-2-3-15-25-21-14-13-17-12-11-16-7-6-10-19-18-8-4-5-9-20(18)24(21)23(17)22(16)19/h4-14H,2-3,15H2,1H3
- InChI Key： AUCHOJIFPAVKEG-UHFFFAOYSA-N
- SMILES： O(CCCC)C1C=CC2=CC=C3C=CC=C4C5C=CC=CC=5C=1C2=C43
Computed Properties
- Exact Mass: 324.151415257g/mol
- Monoisotopic Mass: 324.151415257g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 25
- Rotatable Bond Count: 4
- Complexity: 459
- 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: 9.2?2
Benzopyrene, butoxy- Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
89963-32-6 (Benzopyrene, butoxy-) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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