Vitas-M small molecule compound

butyl (2,2,2-trichloro-1-hydroxyethyl)carbamate

Catalog ID
STK371015
SMILES CCCCOC(=O)NC(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 C7H12Cl3NO3 MW 264.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H12Cl3NO3/c1-2-3-4-14-6(13)11-5(12)7(8,9)10/h5,12H,2-4H2,1H3,(H,11,13)
InChIKey
DKEDAQSPAGTWFM-UHFFFAOYSA-N
Synonyms
89774-72-1
89774721
BUTOXYN(222TRICHLORO1HYDROXYETHYL)CARBOXAMIDE
butyl(222trichloro1hydroxyethyl)carbamate
BUTYLN(222TRICHLORO1HYDROXYETHYL)CARBAMATE
InChI=1SC7H12Cl3NO3c1234146(13)115(12)7(89)10h512H24H21H3(H1113)
MFCD00095622
ZINC000002141215
ZINC000002141217

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Available files

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