Vitas-M small molecule compound

3-(dimethylamino)propyl 4-chlorobenzoate

Catalog ID
STK071043
SMILES CN(CCCOC(=O)c1ccc(cc1)Cl)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 C12H16ClNO2 MW 241.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16ClNO2/c1-14(2)8-3-9-16-12(15)10-4-6-11(13)7-5-10/h4-7H,3,8-9H2,1-2H3
InChIKey
BPHKTOWGCKVQKC-UHFFFAOYSA-N
Synonyms
42957-58-4
3(DIMETHYLAMINO)PROPYL4CHLOROBENZOATE
3(dimethylamino)propyl4chlorobenzoatehydrochloride
42957584
CN(C)CCCOC(=O)C1=CC=C(C=C1)Cl
CN(CCCOC(=O)c1ccc(cc1)Cl)C
CN(CCCOC(=O)c1ccc(cc1)Cl)CCl
InChI=1SC12H16ClNO2c114(2)8391612(15)104611(13)7510h47H389H212H3
MFCD00452287
STK071043
ZINC000001822568
ZINC1822568

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Available files

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