1-(4-methanesulfonyl-2-nitrophenyl)-1,4-diazepane

Compound number
MolPort-000-159-626
CAS number
849035-89-8
IUPAC
1-(4-methanesulfonyl-2-nitrophenyl)-1,4-diazepane
IUPAC traditional
1-(4-methanesulfonyl-2-nitrophenyl)-1,4-diazepane
SMILES
CS(=O)(=O)c1ccc(N2CCCNCC2)c(c1)[N+]([O-])=O
InChI key
IYWJJBSLJUDUFN-UHFFFAOYSA-N
Molecular formula
Molecular weight
299.35
Solubility
not available

Marketplace Offers

Fluorochem Limited

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Purity
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Supplier Catalogue Data

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1 g September 2, 2022 164.45 USD
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MedChemExpress (made-to-order)

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1 g September 9, 2022 389.40 USD
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AK Scientific (made-to-order)

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20.00 USD
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Building blocks
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20 business days
Purity
95.00%
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> 3 months ago
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Supplier Catalogue Data

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1 g September 9, 2022 171.00 USD
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5 g September 9, 2022 616.00 USD
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Compound identifiers

Compound number
MolPort-000-159-626
CAS number
849035-89-8

Names, Synonyms and 3rd Party Identifiers

Name
1-(4-(Methylsulfonyl)-2-nitrophenyl)-1,4-diazepane
1-(4-methanesulfonyl-2-nitrophenyl)-1,4-diazepane
1-[4-(Methylsulfonyl)-2-nitrophenyl]-1,4-diazepane
MFCD04037963

InChI

InChI
1/C12H17N3O4S/c1-20(18,19)10-3-4-11(12(9-10)15(16)17)14-7-2-5-13-6-8-14/h3-4,9,13H,2,5-8H2,1H3
InChI key
IYWJJBSLJUDUFN-UHFFFAOYSA-N

Formula

Molecular formula
C12H17N3O4S
Molecular weight
299.35

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