Vitas-M small molecule compound

2-[(1H-benzotriazol-4-ylamino)methyl]-4,6-dichlorophenol

Catalog ID
STK686269
SMILES Clc1cc(CNc2cccc3c2nn[nH]3)c(c(c1)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 C13H10Cl2N4O MW 309.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10Cl2N4O/c14-8-4-7(13(20)9(15)5-8)6-16-10-2-1-3-11-12(10)18-19-17-11/h1-5,16,20H,6H2,(H,17,18,19)
InChIKey
XJDAMRMBKRZMNY-UHFFFAOYSA-N
Synonyms

2((1Hbenzotriazol4ylamino)methyl)46dichlorophenol
2((2HBENZOTRIAZOL4YLAMINO)METHYL)46DICHLOROPHENOL
6((BENZOTRIAZOL4YLAMINO)METHYL)24DICHLOROPHENOL
C1=CC2=NNN=C2C(=C1)NCC3=CC(=CC(=C3O)Cl)Cl
Clc1cc(CNc2cccc3c2nn(nH)3)c(c(c1)Cl)O
InChI=1SC13H10Cl2N4Oc14847(13(20)9(15)58)616102131112(10)18191711h151620H6H2(H171819)
MFCD06015488
ZINC000019874815
ZINC19874815

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Available files

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