Vitas-M small molecule compound
1-(2,2,2-trichloro-1-hydroxyethyl)azepan-2-one
Catalog ID
STK527571
SMILES O=C1CCCCCN1C(C(Cl)(Cl)Cl)O
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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 C8H12Cl3NO2 MW 260.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H12Cl3NO2/c9-8(10,11)7(14)12-5-3-1-2-4-6(12)13/h7,14H,1-5H2InChIKey
LSPHWJPXRIPNGU-UHFFFAOYSA-NSynonyms
39954-14-81(222trichloro1hydroxyethyl)azepan2one
39954148
C1CCC(=O)N(CC1)C(C(Cl)(Cl)Cl)O
InChI=1SC8H12Cl3NO2c98(1011)7(14)12531246(12)13h714H15H2
MFCD00233507
ZINC000000494849
ZINC000000494850
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