2-ethynyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol
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![2-ethynyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/879ca21b7a5c4ba0aadc48a57eb495f8.png "2-ethynyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol")
2-ethynyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol
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CAS No:
31721-91-2
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Formula:
C16H13NO
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Chemical Name:
2-ethynyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol
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Synonyms:
31721-91-2;5-ethynyl-10,11-dihydro-5H-benzo[4,5]cyclohepta[1,2-b]pyridin-5-ol;BRN 1469717;1-Aza-5H-dibenzo(a,d)cyclohepten-5-ol, 10,11-dihydro-5-ethynyl-;5H-BENZO(4,5)CYCLOHEPTA(1,2-b)PYRIDIN-5-OL, 10,11-DIHYDRO-5-ETHYNYL-;DTXSID70953670
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CAS No:
2-ethynyl-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ol Basic Attributes
235.28 g/mol
235.099714038 g/mol
Computed Properties
Molecular Weight:235.28
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:235.099714038
Monoisotopic Mass:235.099714038
Topological Polar Surface Area:33.1
Heavy Atom Count:18
Complexity:357
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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