Vitas-M small molecule compound

2-[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]ethanamine

Catalog ID
STK664091
SMILES NCCOc1cc(C)c(cc1C(C)C)Cl

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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 C12H18ClNO MW 227.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18ClNO/c1-8(2)10-7-11(13)9(3)6-12(10)15-5-4-14/h6-8H,4-5,14H2,1-3H3
InChIKey
CFZGMLJESZUTFL-UHFFFAOYSA-N
Synonyms
26583-32-4
(2(4CHLORO2ISOPROPYL5METHYLPHENOXY)ETHYL)AMINEHYDROCHLORIDE
2(4CHLORO2ISOPROPYL5METHYLPHENOXY)ETHYLAMINE
2(4CHLORO5METHYL2(METHYLETHYL)PHENOXY)ETHYLAMINE
2(4chloro5methyl2(propan2yl)phenoxy)ethanamine
2(4CHLORO5METHYL2PROPAN2YLPHENOXY)ETHANAMINE
26583324
CC1=CC(=C(C=C1Cl)C(C)C)OCCN
InChI=1SC12H18ClNOc18(2)10711(13)9(3)612(10)155414h68H4514H213H3
MFCD05860828
ZINC000004520664
ZINC4520664

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Available files

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