857812-21-6
4-(4-HYDROXY-BENZYL)-5-METHYL-1,3-DIHYDRO-IMIDAZOLE-2-THIONE
Name4-(4-HYDROXY-BENZYL)-5-METHYL-1,3-DIHYDRO-IMIDAZOLE-2-THIONE
1Identification
【Name】
4-(4-HYDROXY-BENZYL)-5-METHYL-1,3-DIHYDRO-IMIDAZOLE-2-THIONE
【CAS】
【MDL】
MFCD06618358
【English Synonyms】
【Formula】
C11 H12 N2 O S
【MolWeight】
220.295
【Inchi】
InChI=1S/C11H12N2OS/c1-7-10(13-11(15)12-7)6-8-2-4-9(14)5-3-8/h2-5,14H,6H2,1H3,(H2,12,13,15)
【InChIKey】
InChIKey=WOFYYOWIXXRSHN-UHFFFAOYSA-N
【SMILES】
Cc1c([nH]c(=S)[nH]1)Cc2ccc(cc2)O
【MOL File】
4-(4-HYDROXY-BENZYL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(4-HYDROXY-BENZYL)-5-METHYL-1,3-DIHYDRO-IMIDAZOLE-2-THIONE.cml