Vitas-M small molecule compound

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

Catalog ID
STK046036
SMILES [O-][N+](=O)c1ccccc1N1CCNCCC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C11H15N3O2 MW 221.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H15N3O2/c15-14(16)11-5-2-1-4-10(11)13-8-3-6-12-7-9-13/h1-2,4-5,12H,3,6-9H2
InChIKey
KKGIQPLUVKLSNV-UHFFFAOYSA-N
Synonyms
450352-64-4
(O)(N+)(=O)c1ccccc1N1CCNCCC1
1(2NITROPHENYL)(14)DIAZEPANE
1(2NITROPHENYL)14DIAZEPANE
1H14DIAZEPINEHEXAHYDRO1(2NITROPHENYL)
450352644
C1CNCCN(C1)C2=CC=CC=C2(N+)(=O)(O)
InChI=1SC11H15N3O2c1514(16)11521410(11)13836127913h124512H369H2
MFCD00631291
STK046036
ZINC000003877857
ZINC3877857

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Available files

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