144084-01-5
1-O-ACETYL-2,3,5-TRI-O-(4-CHLOROBENZOYL)-BETA-D-RIBOFURANOSE
Name1-O-ACETYL-2,3,5-TRI-O-(4-CHLOROBENZOYL)-BETA-D-RIBOFURANOSE
1Identification
【Name】
1-O-ACETYL-2,3,5-TRI-O-(4-CHLOROBENZOYL)-BETA-D-RIBOFURANOSE
【CAS】
【MDL】
MFCD04039381
【English Synonyms】
【Formula】
C28 H21 Cl3 O9
【MolWeight】
607.824
【Inchi】
InChI=1S/C28H21Cl3O9/c1-15(32)37-28-24(40-27(35)18-6-12-21(31)13-7-18)23(39-26(34)17-4-10-20(30)11-5-17)22(38-28)14-36-25(33)16-2-8-19(29)9-3-16/h2-13,22-24,28H,14H2,1H3/t22-,23-,24-,28-/m1/s1
【InChIKey】
InChIKey=PWENFUAUZHQOQD-CBUXHAPBSA-N
【SMILES】
CC(=O)O[C@H]1[C@@H]([C@@H]([C@H](O1)COC(=O)c2ccc(cc2)Cl)OC(=O)c3ccc(cc3)Cl)OC(=O)c4ccc(cc4)Cl
【MOL File】
1-O-ACETYL-2,3,5-TRI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:9
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-O-ACETYL-2,3,5-TRI-O-(4-CHLOROBENZOYL)-BETA-D-RIBOFURANOSE.cml