Vitas-M small molecule compound

methyl 2-{4-[(cyclopropylmethyl)amino]-3-methoxyphenyl}-3,3,3-trifluoro-2-hydroxypropanoate

Catalog ID
STK638734
SMILES COC(=O)C(C(F)(F)F)(c1ccc(c(c1)OC)NCC1CC1)O

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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 C15H18F3NO4 MW 333.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18F3NO4/c1-22-12-7-10(5-6-11(12)19-8-9-3-4-9)14(21,13(20)23-2)15(16,17)18/h5-7,9,19,21H,3-4,8H2,1-2H3
InChIKey
UBXGGQMDGPYKFU-UHFFFAOYSA-N
Synonyms
1010885-08-1
(R)methyl2(4((cyclopropylmethyl)amino)3methoxyphenyl)333trifluoro2hydroxypropanoate
1010885081
COC1=C(C=CC(=C1)C(C(=O)OC)(C(F)(F)F)O)NCC2CC2
InChI=1SC15H18F3NO4c12212710(5611(12)1989349)14(2113(20)232)15(1617)18h5791921H348H212H3
methyl2(4((cyclopropylmethyl)amino)3methoxyphenyl)333trifluoro2hydroxypropanoate
methyl2(4(cyclopropylmethylamino)3methoxyphenyl)333trifluoro2hydroxypropanoate
MFCD12204432
ZINC000012325005
ZINC000012325006

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Available files

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