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[2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dimethylazanium;2,4,6-trinitrophenolate
[2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dimethylazanium;2,4,6-trinitrophenolate
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![[2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dimethylazanium;2,4,6-trinitrophenolate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/09c3198de30c40a8bc841df5e3b55a1a.png "[2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dimethylazanium;2,4,6-trinitrophenolate")
[2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dimethylazanium;2,4,6-trinitrophenolate
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CAS No:
7565-81-3
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Formula:
C18H18N4O8S
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Chemical Name:
[2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dimethylazanium;2,4,6-trinitrophenolate
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Synonyms:
alpha-(Dimethylaminomethyl)benzo(b)thiophene-3-methanol picrate;BENZO(b)THIOPHENE-3-METHANOL, alpha-(DIMETHYLAMINOMETHYL)-, PICRATE
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CAS No:
[2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dimethylazanium;2,4,6-trinitrophenolate Basic Attributes
450.4 g/mol
450.08453472 g/mol
Computed Properties
Molecular Weight:450.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:3
Exact Mass:450.08453472
Monoisotopic Mass:450.08453472
Topological Polar Surface Area:213
Heavy Atom Count:31
Complexity:501
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
Guide of [2-(1-benzothiophen-3-yl)-2-hydroxyethyl]-dimethylazanium;2,4,6-trinitrophenolate
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