Vitas-M small molecule compound

methyl 5-{[bis(2-chloroethyl)amino]methyl}-2-methoxybenzoate

Catalog ID
STL000227
SMILES ClCCN(Cc1ccc(c(c1)C(=O)OC)OC)CCCl

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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 C14H19Cl2NO3 MW 320.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19Cl2NO3/c1-19-13-4-3-11(9-12(13)14(18)20-2)10-17(7-5-15)8-6-16/h3-4,9H,5-8,10H2,1-2H3
InChIKey
QEOJFNCBXZJLAL-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)CN(CCCl)CCCl)C(=O)OC
InChI=1SC14H19Cl2NO3c119134311(912(13)14(18)202)1017(7515)8616h349H5810H212H3
methyl5((bis(2chloroethyl)amino)methyl)2methoxybenzoate
METHYL5(BIS(2CHLOROETHYL)AMINOMETHYL)2METHOXYBENZOATE
MFCD03666412
ZINC000004994442
ZINC4994442

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Available files

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