Vitas-M small molecule compound

methyl 4-butoxybenzoate

Catalog ID
STK425767
SMILES CCCCOc1ccc(cc1)C(=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 C12H16O3 MW 208.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16O3/c1-3-4-9-15-11-7-5-10(6-8-11)12(13)14-2/h5-8H,3-4,9H2,1-2H3
InChIKey
PUHCYTHGLBCWEA-UHFFFAOYSA-N
Synonyms
4906-25-6
4906256
4BUTOXYBENZOICACIDMETHYLESTER
BENZOICACID4BUTYLOXYMETHYLESTER
CCCCOC1=CC=C(C=C1)C(=O)OC
InChI=1SC12H16O3c134915117510(6811)12(13)142h58H349H212H3
methyl4butoxybenzoate
METHYL4NBUTOXYBENZOATE
METHYL4NBUTYLOXYBENZOATE
MFCD00070801
ZINC000002149420
ZINC02149420
ZINC2149420

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Available files

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