6-nitro-3-oxapentacyclo[7.6.2.02,4.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene
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![6-nitro-3-oxapentacyclo[7.6.2.02,4.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/524efdf7d7214a53a1de2439d45ecac5.png "6-nitro-3-oxapentacyclo[7.6.2.02,4.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene")
6-nitro-3-oxapentacyclo[7.6.2.02,4.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene
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CAS No:
105596-43-8
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Formula:
C16H9NO3
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Chemical Name:
6-nitro-3-oxapentacyclo[7.6.2.02,4.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene
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Synonyms:
1-nitropyrene-9,10-oxide;1-NP 9,10-oxide;9,10-EDNP;9,10-epoxy-9,10-dihydro-1-nitropyrene;1-Nitropyrene-9,10-oxide;1-Nitropyrene 9,10-oxide;105596-43-8;CCRIS 2127;Pyrene, 4,5-dihydro-4,5-epoxy-3-nitro-;8b,9a-Dihydro-1-nitropyreno(4,5-b)oxirene;9,10-epoxy-9,10-dihydro-1-nitropyrene;Pyreno(4,5-b)oxirene, 8b,9a-dihydro-1-nitro-;DTXSID90909619;9,10-Dihydro-9,10-epoxy-1-nitropyrene;1-Nitro-8b,9a-dihydropyreno[4,5-b]oxirene
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CAS No:
6-nitro-3-oxapentacyclo[7.6.2.02,4.05,17.012,16]heptadeca-1(15),5,7,9(17),10,12(16),13-heptaene Basic Attributes
263.25 g/mol
263.058243149 g/mol
Computed Properties
Molecular Weight:263.25
XLogP3:3.3
Hydrogen Bond Acceptor Count:3
Exact Mass:263.058243149
Monoisotopic Mass:263.058243149
Topological Polar Surface Area:58.4
Heavy Atom Count:20
Complexity:448
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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