Vitas-M small molecule compound
2-(2,4-di-tert-butylphenoxy)ethyl 4-nitrobenzoate
Catalog ID
STK031152
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])OCCOc1ccc(cc1C(C)(C)C)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 C23H29NO5 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO5/c1-22(2,3)17-9-12-20(19(15-17)23(4,5)6)28-13-14-29-21(25)16-7-10-18(11-8-16)24(26)27/h7-12,15H,13-14H2,1-6H3InChIKey
NKBOHQIDOWPHPW-UHFFFAOYSA-NSynonyms
2(24DITERTBUTYLPHENOXY)ETHYL4NITROBENZOATE
4NITROBENZOICACID2(24DITERTBUTYLPHENOXY)ETHYLESTER
CC(C)(C)C1=CC(=C(C=C1)OCCOC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C(C)(C)C
InChI=1SC23H29NO5c122(23)1791220(19(1517)23(45)6)2813142921(25)1671018(11816)24(26)27h71215H1314H216H3
MFCD01017484
O=C(c1ccc(cc1)(N+)(=O)(O))OCCOc1ccc(cc1C(C)(C)C)C(C)(C)C
STK031152
ZINC000004603708
ZINC04603708
ZINC4603708
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