CAS
403990-81-8 Purity
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403990-81-8 Purity
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![3-[8-Chloro-5-[3-(dimethylazaniumyl)propyl]-5-hydroxy-4-phenyl-2,3-dihydro-1-benzoxepin-4-yl]propyl-dimethylazanium dichloride](https://resource.alfa-chemistry.com/structure/40400-49-5.gif)
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Acetamide,N-(10,11-dihydro-11-(4-methyl-(piperazin-1-yl))dibenzo[b,f]thiepin-2-yl)-,methanesulfonate,hydrate(1:2:1)
CAS
40400-08-6
Catalog Number
ACM40400086
Category
Other Products
Molecular Weight
559.719020
Molecular Formula
C23H33N3O7S3
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Specification
IUPAC Name
methanesulfonic acid; N-[5-(4-methylpiperazin-1-yl)-5,6-dihydrobenzo[b][1]benzothiepin-3-yl]acetamide
Canonical SMILES
CC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3CC2N4CCN(CC4)C.CS(=O)(=O)O.CS(=O)(=O)O
InChI Key
DIYUOZREAZXKTP-UHFFFAOYSA-N
Boiling Point
528.9ºC at 760 mmHg
Flash Point
273.6ºC
Exact Mass
559.14800
H-Bond Acceptor
9
H-Bond Donor
3
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404001-70-3 Purity
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404001-70-3 Purity
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