Vitas-M small molecule compound

2-chloro-3-(cyclohexylamino)naphthalene-1,4-dione

Catalog ID
STK033554
SMILES ClC1=C(NC2CCCCC2)C(=O)c2c(C1=O)cccc2

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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 C16H16ClNO2 MW 289.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClNO2/c17-13-14(18-10-6-2-1-3-7-10)16(20)12-9-5-4-8-11(12)15(13)19/h4-5,8-10,18H,1-3,6-7H2
InChIKey
AVJLACWTIMBBBX-UHFFFAOYSA-N
Synonyms
84349-14-4
2CHLORO3(CYCLOHEXYLAMINO)NAPHTHALENE14DIONE
84349144
C1CCC(CC1)NC2=C(C(=O)C3=CC=CC=C3C2=O)Cl
ClC1=C(NC2CCCCC2)C(=O)c2c(C1=O)cccc2
InChI=1SC16H16ClNO2c171314(18106213710)16(20)12954811(12)15(13)19h4581018H1367H2
MFCD00029190
STK033554
ZINC000000548728
ZINC00548728
ZINC548728

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Available files

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