20618-50-2
1-(4-METHOXYPHENYL)-3-[(4-METHYLPHENYL)SULFANYL]-1-PROPANONE
Name1-(4-METHOXYPHENYL)-3-[(4-METHYLPHENYL)SULFANYL]-1-PROPANONE
1Identification
【Name】
1-(4-METHOXYPHENYL)-3-[(4-METHYLPHENYL)SULFANYL]-1-PROPANONE
【CAS】
【MDL】
MFCD01568272
【English Synonyms】
【Formula】
C17 H18 O2 S
【MolWeight】
286.393
【Inchi】
InChI=1S/C17H18O2S/c1-13-3-9-16(10-4-13)20-12-11-17(18)14-5-7-15(19-2)8-6-14/h3-10H,11-12H2,1-2H3
【InChIKey】
InChIKey=GNDCXXVPTSEXFD-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)SCCC(=O)c2ccc(cc2)OC
【MOL File】
1-(4-METHOXYPHENYL)-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(4-METHOXYPHENYL)-3-[(4-METHYLPHENYL)SULFANYL]-1-PROPANONE.cml