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.

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

Methyl benzenesulfonate	Predict NMR spectrum	RN:  80-18-2 MF:  C7H8O3S MW:  172.19872 mp (°C):  -4 density:  1.3 nd:  1.514  - 1.516
InChI:  1S/C7H8O3S/c1-10-11(8,9)7-5-3-2-4-6-7/h2-6H,1H3 InChIKey:  CZXGXYBOQYQXQD-UHFFFAOYSA-N	H donor:  0 H acceptor:  3 Rotatable bond:  2 Stereocenter:  0	cLogP:  0.998 cLogS:  -0.777 Polar surface:  51.75 NEW: 3D model:  Show
Permanent link: http://www.chemexper.com/search/cas/80182.html		Report error(s)

ChemExper Chemical Directory : catalog of chemicals and suppliers