Vitas-M small molecule compound

methyl N-[(2-fluorophenyl)carbonyl]valinate

Catalog ID
STK289171
SMILES COC(=O)C(C(C)C)NC(=O)c1ccccc1F

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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 C13H16FNO3 MW 253.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16FNO3/c1-8(2)11(13(17)18-3)15-12(16)9-6-4-5-7-10(9)14/h4-8,11H,1-3H3,(H,15,16)
InChIKey
RKJCUCVCGGLLRV-UHFFFAOYSA-N
Synonyms
1008473-91-3
1008473913
CC(C)C(C(=O)OC)NC(=O)C1=CC=CC=C1F
InChI=1SC13H16FNO3c18(2)11(13(17)183)1512(16)9645710(9)14h4811H13H3(H1516)
LVALINEN(2FLUOROBENZOYL)METHYLESTER
METHYL2((2FLUOROBENZOYL)AMINO)3METHYLBUTANOATE
methylN((2fluorophenyl)carbonyl)valinate
MFCD07688037
ZINC000007736477
ZINC000007736478

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Available files

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