Vitas-M small molecule compound

2-(4-ethoxy-3-methoxyphenyl)-4,4-diethyl-1,4-dihydro-2H-3,1-benzoxazine

Catalog ID
STK679134
SMILES CCOc1ccc(cc1OC)C1Nc2ccccc2C(O1)(CC)CC

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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 C21H27NO3 MW 341.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO3/c1-5-21(6-2)16-10-8-9-11-17(16)22-20(25-21)15-12-13-18(24-7-3)19(14-15)23-4/h8-14,20,22H,5-7H2,1-4H3
InChIKey
MBESGPPOUMTCCH-UHFFFAOYSA-N
Synonyms
5776-41-0
2(4ETHOXY3METHOXYPHENYL)44DIETHYL12DIHYDRO31BENZOXAZINE
2(4ethoxy3methoxyphenyl)44diethyl14dihydro2H31benzoxazine
4(44DIETHYL(1H2HBENZO(D)13OXAZIN2YL))1ETHOXY2METHOXYBENZENE
5776410
CCC1(C2=CC=CC=C2NC(O1)C3=CC(=C(C=C3)OCC)OC)CC
InChI=1SC21H27NO3c1521(62)1610891117(16)2220(2521)15121318(2473)19(1415)234h8142022H57H214H3
MFCD03408493
ZINC000000033653
ZINC000000033654

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Available files

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