Vitas-M small molecule compound

6-bromo-3-(3,5-dimethylphenyl)-3,4-dihydro-2H-1,3-benzoxazine

Catalog ID
STK793180
SMILES Brc1ccc2c(c1)CN(CO2)c1cc(C)cc(c1)C

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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 C16H16BrNO MW 318.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16BrNO/c1-11-5-12(2)7-15(6-11)18-9-13-8-14(17)3-4-16(13)19-10-18/h3-8H,9-10H2,1-2H3
InChIKey
MDVLCMDGUVGCRP-UHFFFAOYSA-N
Synonyms
797021-45-5
6BROMO3(35DIMETHYLPHENYL)24DIHYDRO13BENZOXAZINE
6bromo3(35dimethylphenyl)34dihydro2H13benzoxazine
6bromo3(35dimethylphenyl)34dihydro2Hbenzo(e)(13)oxazine
797021455
CC1=CC(=CC(=C1)N2CC3=C(C=CC(=C3)Br)OC2)C
InChI=1SC16H16BrNOc111512(2)715(611)18913814(17)3416(13)191018h38H910H212H3
MFCD03663871
ZINC000000529320
ZINC00529320
ZINC529320

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Available files

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