Vitas-M small molecule compound
1-(3-methylbutoxy)-4-[(E)-2-nitroethenyl]benzene
Catalog ID
STL069447
SMILES CC(CCOc1ccc(cc1)/C=C/[N+](=O)[O-])C
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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 C13H17NO3 MW 235.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO3/c1-11(2)8-10-17-13-5-3-12(4-6-13)7-9-14(15)16/h3-7,9,11H,8,10H2,1-2H3/b9-7+InChIKey
GOPLDGTYUXGBCU-VQHVLOKHSA-NSynonyms
1(3methylbutoxy)4((E)2nitroethenyl)benzene
1(3METHYLBUTOXY)4(2NITROETHENYL)BENZENE
4((1E)2NITROVINYL)1(3METHYLBUTOXY)BENZENE
CC(C)CCOC1=CC=C(C=C1)C=C(N+)(=O)(O)
CC(CCOc1ccc(cc1)C=C(N+)(=O)(O))C
InChI=1SC13H17NO3c111(2)81017135312(4613)7914(15)16h37911H810H212H3b97+
MFCD13250127
ZINC000038534536
ZINC38534536
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