1-(9,11-dimethyl-4-phenyl-2,5,7,12-tetraza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(12),4,6,8,10-pentaen-3-ylidene)ethanolate
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1-(9,11-dimethyl-4-phenyl-2,5,7,12-tetraza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(12),4,6,8,10-pentaen-3-ylidene)ethanolate
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CAS No:
77077-67-9
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Formula:
C17H15N5O
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Chemical Name:
1-(9,11-dimethyl-4-phenyl-2,5,7,12-tetraza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(12),4,6,8,10-pentaen-3-ylidene)ethanolate
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Synonyms:
Z56793544;3-acetyl-9,11-dimethyl-4-phenyl-2,5,7,8lambda5,12-pentaazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),3,6,9,11-pentaen-8-ylium-5-ide;77077-67-9
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CAS No:
1-(9,11-dimethyl-4-phenyl-2,5,7,12-tetraza-8-azoniatricyclo[6.4.0.02,6]dodeca-1(12),4,6,8,10-pentaen-3-ylidene)ethanolate Basic Attributes
305.33 g/mol
305.12766012 g/mol
Computed Properties
Molecular Weight:305.33
XLogP3:3.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:305.12766012
Monoisotopic Mass:305.12766012
Topological Polar Surface Area:70.2
Heavy Atom Count:23
Complexity:539
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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