57841-33-5
3,4,5,6-TETRAHYDRO-6-(O-TOLYLOXYMETHYL)-2H-1,3-OXAZINE-2-THIONE
Name3,4,5,6-TETRAHYDRO-6-(O-TOLYLOXYMETHYL)-2H-1,3-OXAZINE-2-THIONE
1Identification
【Name】
3,4,5,6-TETRAHYDRO-6-(O-TOLYLOXYMETHYL)-2H-1,3-OXAZINE-2-THIONE
【CAS】
【MDL】
MFCD01710090
【English Synonyms】
【Formula】
C12 H15 N O2 S
【MolWeight】
237.322
【Inchi】
InChI=1S/C12H15NO2S/c1-9-4-2-3-5-11(9)14-8-10-6-7-13-12(16)15-10/h2-5,10H,6-8H2,1H3,(H,13,16)
【InChIKey】
InChIKey=WPTWMKBYRMIOTE-UHFFFAOYSA-N
【SMILES】
Cc1ccccc1OCC2CCNC(=S)O2
【MOL File】
3,4,5,6-TETRAHYDRO-6….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,4,5,6-TETRAHYDRO-6-(O-TOLYLOXYMETHYL)-2H-1,3-OXAZINE-2-THIONE.cml