3-chloro-1,2-dihydrobenzo[b][1]benzothiepine-6-carboxylic acid
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![3-chloro-1,2-dihydrobenzo[b][1]benzothiepine-6-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2b843c27502b492cb74b7d130b496615.png "3-chloro-1,2-dihydrobenzo[b][1]benzothiepine-6-carboxylic acid")
3-chloro-1,2-dihydrobenzo[b][1]benzothiepine-6-carboxylic acid
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CAS No:
87033-45-2
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Formula:
C15H11ClO2S
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Chemical Name:
3-chloro-1,2-dihydrobenzo[b][1]benzothiepine-6-carboxylic acid
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Synonyms:
DIBENZO(b,f)THIEPIN-10-CARBOXYLIC ACID, 10,11-DIHYDRO-2-CHLORO-;87033-45-2;BRN 4479106;10,11-Dihydro-2-chlorodibenzo(b,f)thiepin-10-carboxylic acid;2-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-carboxylic acid;DTXSID50236079
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CAS No:
3-chloro-1,2-dihydrobenzo[b][1]benzothiepine-6-carboxylic acid Basic Attributes
290.8 g/mol
290.0168285 g/mol
DTXSID50236079
Computed Properties
Molecular Weight:290.8
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:290.0168285
Monoisotopic Mass:290.0168285
Topological Polar Surface Area:62.6
Heavy Atom Count:19
Complexity:504
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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