50539-69-0
((2,4-XYLYL)THIO)METHYLCARBAMIC ACID 2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANYL ESTER
Name((2,4-XYLYL)THIO)METHYLCARBAMIC ACID 2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANYL ESTER
1Identification
【Name】
((2,4-XYLYL)THIO)METHYLCARBAMIC ACID 2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANYL ESTER
【CAS】
【MDL】
MFCD01738204
【English Synonyms】
【Formula】
C20 H23 N O3 S
【MolWeight】
357.472
【Inchi】
InChI=1S/C20H23NO3S/c1-13-9-10-17(14(2)11-13)25-21(5)19(22)23-16-8-6-7-15-12-20(3,4)24-18(15)16/h6-11H,12H2,1-5H3
【InChIKey】
InChIKey=VWSNJSIFHLGUKB-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)C)SN(C)C(=O)Oc2cccc3c2OC(C3)(C)C
【MOL File】
((2,4-XYLYL)THIO)MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
((2,4-XYLYL)THIO)METHYLCARBAMIC ACID 2,3-DIHYDRO-2,2-DIMETHYL-7-BENZOFURANYL ESTER.cml