3-nitropentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9,11,13,15,17,19-nonaene
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3-nitropentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9,11,13,15,17,19-nonaene
structure -
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CAS No:
2961-09-3
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Formula:
C20H13NO2
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Chemical Name:
3-nitropentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9,11,13,15,17,19-nonaene
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Synonyms:
1-nitro triptycene;NSC102285;NCIOpen2_006870;ZINC4945994;NSC-102285;2961-09-3
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CAS No:
3-nitropentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9,11,13,15,17,19-nonaene Basic Attributes
299.3 g/mol
299.094628657 g/mol
102285
Computed Properties
Molecular Weight:299.3
XLogP3:4.7
Hydrogen Bond Acceptor Count:2
Exact Mass:299.094628657
Monoisotopic Mass:299.094628657
Topological Polar Surface Area:45.8
Heavy Atom Count:23
Complexity:463
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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