Vitas-M small molecule compound

1-[3-(6-chloro-2H-1,3-benzoxazin-3(4H)-yl)phenyl]ethanone

Catalog ID
STK876222
SMILES Clc1ccc2c(c1)CN(CO2)c1cccc(c1)C(=O)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 C16H14ClNO2 MW 287.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClNO2/c1-11(19)12-3-2-4-15(8-12)18-9-13-7-14(17)5-6-16(13)20-10-18/h2-8H,9-10H2,1H3
InChIKey
AGSWOFHOJJDTNP-UHFFFAOYSA-N
Synonyms
684238-57-1
1(3(6CHLORO24DIHYDRO13BENZOXAZIN3YL)PHENYL)ETHANONE
1(3(6chloro2H13benzoxazin3(4H)yl)phenyl)ethanone
1(3(6chloro2Hbenzo(e)(13)oxazin3(4H)yl)phenyl)ethanone
684238571
CC(=O)C1=CC(=CC=C1)N2CC3=C(C=CC(=C3)Cl)OC2
InChI=1SC16H14ClNO2c111(19)1232415(812)18913714(17)5616(13)201018h28H910H21H3
MFCD03666504
ZINC000000099881
ZINC00099881
ZINC99881

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Available files

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