62414-75-9
2,3,4-TRI-O-ACETYL-ALPHA-D-ARABINOPYRANOSYL ISOTHIOCYANATE
Name2,3,4-TRI-O-ACETYL-ALPHA-D-ARABINOPYRANOSYL ISOTHIOCYANATE
1Identification
【Name】
2,3,4-TRI-O-ACETYL-ALPHA-D-ARABINOPYRANOSYL ISOTHIOCYANATE
【CAS】
【MDL】
MFCD00142781
【English Synonyms】
【Formula】
C12 H15 N O7 S
【MolWeight】
317.316
【Inchi】
InChI=1S/C12H15NO7S/c1-6(14)18-9-4-17-12(13-5-21)11(20-8(3)16)10(9)19-7(2)15/h9-12H,4H2,1-3H3/t9-,10-,11+,12+/m1/s1
【InChIKey】
InChIKey=RCHZRAFPHKCWRI-WYUUTHIRSA-N
【SMILES】
CC(=O)O[C@@H]1CO[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)N=C=S
【MOL File】
2,3,4-TRI-O-ACETYL-A….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,3,4-TRI-O-ACETYL-ALPHA-D-ARABINOPYRANOSYL ISOTHIOCYANATE.cml