11,11-dioxobenzo[b][1]benzothiepine-2-carboxylic acid
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![11,11-dioxobenzo[b][1]benzothiepine-2-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/be613e6afe2341ec9425a13309e7361f.png "11,11-dioxobenzo[b][1]benzothiepine-2-carboxylic acid")
11,11-dioxobenzo[b][1]benzothiepine-2-carboxylic acid
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CAS No:
71474-64-1
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Formula:
C15H10O4S
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Chemical Name:
11,11-dioxobenzo[b][1]benzothiepine-2-carboxylic acid
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Synonyms:
dibenzo(b,f)thiepin-3-carboxylic acid 5,5-dioxide;L 636499;L-636499;L636499;UNII-7S1U62U7AD;71474-64-1;L 636499;L-636499;dibenzo[b,f]thiepine-3-carboxylic acid 5,5-dioxide;7S1U62U7AD;Dibenzo(b,f)thiepin-3-carboxylic acid 5,5-dioxide;DIBENZO[B,F]THIEPIN-3-CARBOXYLIC ACID 5,5-DIOXIDE;L636499;Dibenzo(b,f)thiepin-3-carboxylic acid, 5,5-dioxide;SCHEMBL9680859;11,11-dioxobenzo[b][1]benzothiepine-2-carboxylic acid;DTXSID90221686;dibenzo[b,f]thiepin3-carboxylic acid 5,5-dioxide;dibenzo[b,f]thiepin-3-carboxylic acid-5,5-dioxide;Q27268771
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CAS No:
11,11-dioxobenzo[b][1]benzothiepine-2-carboxylic acid Basic Attributes
286.3 g/mol
286.02997997 g/mol
7S1U62U7AD
DTXSID90221686
Computed Properties
Molecular Weight:286.3
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:286.02997997
Monoisotopic Mass:286.02997997
Topological Polar Surface Area:79.8
Heavy Atom Count:20
Complexity:517
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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