56879-48-2
2-DEOXY-2-(DI-2-CHLOROETHYL)AMINO-1,3,4,6-TETRAACETOXY-D-GLUCOPYRANOSE
Name2-DEOXY-2-(DI-2-CHLOROETHYL)AMINO-1,3,4,6-TETRAACETOXY-D-GLUCOPYRANOSE
1Identification
【Name】
2-DEOXY-2-(DI-2-CHLOROETHYL)AMINO-1,3,4,6-TETRAACETOXY-D-GLUCOPYRANOSE
【CAS】
【MDL】
MFCD01725403
【English Synonyms】
【Formula】
C18 H27 Cl2 N O9
【MolWeight】
472.315
【Inchi】
InChI=1S/C18H27Cl2NO9/c1-10(22)26-9-14-16(27-11(2)23)17(28-12(3)24)15(18(30-14)29-13(4)25)21(7-5-19)8-6-20/h14-18H,5-9H2,1-4H3/t14-,15-,16-,17-,18?/m1/s1
【InChIKey】
InChIKey=IBVNNVNKILNDQJ-XNIMBYMISA-N
【SMILES】
CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H](C(O1)OC(=O)C)N(CCCl)CCCl)OC(=O)C)OC(=O)C
【MOL File】
2-DEOXY-2-(DI-2-CHLO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:10
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-DEOXY-2-(DI-2-CHLOROETHYL)AMINO-1,3,4,6-TETRAACETOXY-D-GLUCOPYRANOSE.cml