Vitas-M small molecule compound

N-(4-nitrobenzyl)pentan-3-amine

Catalog ID
STK145500
SMILES CCC(NCc1ccc(cc1)[N+](=O)[O-])CC

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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 C12H18N2O2 MW 222.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N2O2/c1-3-11(4-2)13-9-10-5-7-12(8-6-10)14(15)16/h5-8,11,13H,3-4,9H2,1-2H3
InChIKey
SRQUOYRAULLNEY-UHFFFAOYSA-N
Synonyms
418774-60-4
(1ETHYLPROPYL)(4NITROBENZYL)AMINE
(ETHYLPROPYL)((4NITROPHENYL)METHYL)AMINE
418774604
CCC(CC)NCC1=CC=C(C=C1)(N+)(=O)(O)
CCC(NCc1ccc(cc1)(N+)(=O)(O))CC
InChI=1SC12H18N2O2c1311(42)139105712(8610)14(15)16h581113H349H212H3
MFCD01129732
N((4NITROPHENYL)METHYL)PENTAN3AMINE
N(4NITROBENZYL)PENTAN3AMINE
ZINC000004685483
ZINC4685483

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.