Vitas-M small molecule compound

5-{[3-(trifluoromethyl)phenoxy]methyl}-1H-tetrazole

Catalog ID
STK667396
SMILES FC(c1cccc(c1)OCc1nnn[nH]1)(F)F

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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 C9H7F3N4O MW 244.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7F3N4O/c10-9(11,12)6-2-1-3-7(4-6)17-5-8-13-15-16-14-8/h1-4H,5H2,(H,13,14,15,16)
InChIKey
HQRAENSJWZABTI-UHFFFAOYSA-N
Synonyms
23582-47-0
23582470
5((3(trifluoromethyl)phenoxy)methyl)1Htetrazole
5((3(TRIFLUOROMETHYL)PHENOXY)METHYL)2HTETRAZOLE
5(3TRIFLUOROMETHYLPHENOXYMETHYL)1HTETRAZOLE
C1=CC(=CC(=C1)OCC2=NNN=N2)C(F)(F)F
FC(c1cccc(c1)OCc1nnn(nH)1)(F)F
InChI=1SC9H7F3N4Oc109(1112)62137(46)1758131516148h14H5H2(H13141516)
MFCD06017544
ZINC000004488000
ZINC4488000

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Available files

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