Visit our website to find more information like suppliers, MSDS, infra-red (IR), nuclear magnetic resonance spectra (NMR), bp, mp, nd20, molecular formula (MF), molfile, sdf file, structure, 3d model. You will also find information like safety, risk, hazard and MSDS. This database is a catalog of over 1500000 chemicals and over 1000 chemical suppliers. If you are a supplier you may also add your own catalog of chemicals for free.

Enter a name, molecular formula, cas number or SMILES more info Find chemicals.  Search by structure  Advanced Search

3-Oxo-3-[4-(trifluoromethoxy)phenyl]propanenitrile	Predict NMR spectrum	RN:  122454-46-0 MF:  C10H6F3NO2 MW:  229.158349 mp (°C):  82  - 84
InChI:  1S/C10H6F3NO2/c11-10(12,13)16-8-3-1-7(2-4-8)9(15)5-6-14/h1-4H,5H2 InChIKey:  IYZQGBBCANKWMX-UHFFFAOYSA-N	H donor:  0 H acceptor:  3 Rotatable bond:  4 Stereocenter:  0	cLogP:  2.747 cLogS:  -3.74 Polar surface:  50.09
Permanent link: http://www.chemexper.com/search/cas/122454460.html		Report error(s)

ChemExper Chemical Directory : catalog of chemicals and suppliers