Vitas-M small molecule compound

3-[2-(2,4-dichlorophenyl)ethyl]-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazine

Catalog ID
STK405050
SMILES Clc1ccc(c(c1)Cl)CCN1COc2c(C1)c(C)cc(c2)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 C18H19Cl2NO MW 336.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19Cl2NO/c1-12-7-13(2)16-10-21(11-22-18(16)8-12)6-5-14-3-4-15(19)9-17(14)20/h3-4,7-9H,5-6,10-11H2,1-2H3
InChIKey
PVJJPWMQBMVACT-UHFFFAOYSA-N
Synonyms

3(2(24DICHLOROPHENYL)ETHYL)57DIMETHYL24DIHYDRO13BENZOXAZINE
3(2(24DICHLOROPHENYL)ETHYL)57DIMETHYL2H4HBENZO(E)13OXAZAPERHYDROINE
3(2(24dichlorophenyl)ethyl)57dimethyl34dihydro2H13benzoxazine
CC1=CC(=C2CN(COC2=C1)CCC3=C(C=C(C=C3)Cl)Cl)C
InChI=1SC18H19Cl2NOc112713(2)161021(112218(16)812)65143415(19)917(14)20h3479H561011H212H3
MFCD03829874
ZINC000020344930
ZINC20344930

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Available files

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