135861-56-2
1,3:2,4-BIS(3,4-DIMETHYLOBENZYLIDENO) SORBITOL
Name1,3:2,4-BIS(3,4-DIMETHYLOBENZYLIDENO) SORBITOL
1Identification
【Name】
1,3:2,4-BIS(3,4-DIMETHYLOBENZYLIDENO) SORBITOL
【CAS】
【MDL】
MFCD09038711
【English Synonyms】
【Formula】
C24 H30 O6
【MolWeight】
414.495
【Inchi】
InChI=1S/C24H30O6/c1-13-5-7-17(9-15(13)3)23-27-12-20-22(30-23)21(19(26)11-25)29-24(28-20)18-8-6-14(2)16(4)10-18/h5-10,19-26H,11-12H2,1-4H3/t19-,20+,21-,22-,23?,24?/m1/s1
【InChIKey】
InChIKey=YWEWWNPYDDHZDI-JJKKTNRVSA-N
【SMILES】
Cc1ccc(cc1C)C2OC[C@H]3[C@@H](O2)[C@H](OC(O3)c4ccc(c(c4)C)C)[C@@H](CO)O
【MOL File】
1,3:2,4-BIS(3,4-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1,3:2,4-BIS(3,4-DIMETHYLOBENZYLIDENO) SORBITOL.cml