Vitas-M small molecule compound

5-tert-butyl-4-(pyrrolidin-1-ylmethyl)furan-2-carboxylic acid

Catalog ID
STK111686
SMILES OC(=O)c1cc(c(o1)C(C)(C)C)CN1CCCC1

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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 C14H21NO3 MW 251.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21NO3/c1-14(2,3)12-10(8-11(18-12)13(16)17)9-15-6-4-5-7-15/h8H,4-7,9H2,1-3H3,(H,16,17)
InChIKey
ZWBHXRUFALBLQB-UHFFFAOYSA-N
Synonyms

5(TERTBUTYL)4(PYRROLIDINYLMETHYL)FURAN2CARBOXYLICACID
5TERTBUTYL4(PYRROLIDIN1IUM1YLMETHYL)FURAN2CARBOXYLATE
5TERTBUTYL4(PYRROLIDIN1YLMETHYL)FURAN2CARBOXYLICACID
5TERTBUTYL4PYRROLIDIN1YLMETHYLFURAN2CARBOXYLICACID
CC(C)(C)C1=C(C=C(O1)C(=O)(O))C(NH+)2CCCC2
InChI=1SC14H21NO3c114(23)1210(811(1812)13(16)17)915645715h8H479H213H3(H1617)
MFCD03765486
ZINC000004364943
ZINC04364943
ZINC4364943

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Available files

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