Vitas-M small molecule compound

dimethyl (2E)-2-[1-(cyclohexylamino)ethylidene]butanedioate

Catalog ID
STK084461
SMILES COC(=O)/C(=C(/NC1CCCCC1)\C)/CC(=O)OC

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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 C14H23NO4 MW 269.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H23NO4/c1-10(15-11-7-5-4-6-8-11)12(14(17)19-3)9-13(16)18-2/h11,15H,4-9H2,1-3H3/b12-10+
InChIKey
BDZKBDFBCNZWNM-ZRDIBKRKSA-N
Synonyms

CC(=C(CC(=O)OC)C(=O)OC)NC1CCCCC1
COC(=O)C(=C(NC1CCCCC1)C)CC(=O)OC
DIMETHYL(2E)2(1(CYCLOHEXYLAMINO)ETHYLIDENE)BUTANEDIOATE
DIMETHYL2((CYCLOHEXYLAMINO)ETHYLIDENE)BUTANE14DIOATE
InChI=1SC14H23NO4c110(15117546811)12(14(17)193)913(16)182h1115H49H213H3b1210+
MFCD01153764
STK084461
ZINC000013893725
ZINC13893725

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Available files

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