Vitas-M small molecule compound
4-tert-butylphenyl 3-nitrobenzoate
Catalog ID
STL169275
SMILES O=C(c1cccc(c1)[N+](=O)[O-])Oc1ccc(cc1)C(C)(C)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 C17H17NO4 MW 299.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO4/c1-17(2,3)13-7-9-15(10-8-13)22-16(19)12-5-4-6-14(11-12)18(20)21/h4-11H,1-3H3InChIKey
MNMKHINJMQCANJ-UHFFFAOYSA-NSynonyms
(4TERTBUTYLPHENYL)3NITROBENZOATE
3NITROBENZOICACID4TERTBUTYLPHENYLESTER
4(TERTBUTYL)PHENYL3NITROBENZOATE
4tertbutylphenyl3nitrobenzoate
CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC17H17NO4c117(23)137915(10813)2216(19)1254614(1112)18(20)21h411H13H3
MFCD00409009
ZINC000002755846
ZINC02755846
ZINC2755846
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