Vitas-M small molecule compound

7-chloro-4-cyclopropyl-2-methyl-4,5-dihydro-1,4-benzoxazepin-3(2H)-one

Catalog ID
STL130379
SMILES Clc1ccc2c(c1)CN(C1CC1)C(=O)C(O2)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 C13H14ClNO2 MW 251.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14ClNO2/c1-8-13(16)15(11-3-4-11)7-9-6-10(14)2-5-12(9)17-8/h2,5-6,8,11H,3-4,7H2,1H3
InChIKey
LUORIJQEKUUIQC-UHFFFAOYSA-N
Synonyms

7chloro4cyclopropyl2methyl45dihydro14benzoxazepin3(2H)one
7chloro4cyclopropyl2methyl5H14benzoxazepin3one
CC1C(=O)N(CC2=C(O1)C=CC(=C2)Cl)C3CC3
InChI=1SC13H14ClNO2c1813(16)15(113411)79610(14)2512(9)178h256811H347H21H3
MFCD20749811
ZINC000064542480
ZINC000064542481

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Available files

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