176590-77-5
(2R,3R)-2,3-DIHYDROXYBUTANE-1,4-DIYL DIBENZOATE
Name(2R,3R)-2,3-DIHYDROXYBUTANE-1,4-DIYL DIBENZOATE
1Identification
【Name】
(2R,3R)-2,3-DIHYDROXYBUTANE-1,4-DIYL DIBENZOATE
【CAS】
【MDL】
MFCD09749859
【English Synonyms】
【Formula】
C18 H18 O6
【MolWeight】
330.334
【Inchi】
InChI=1S/C18H18O6/c19-15(11-23-17(21)13-7-3-1-4-8-13)16(20)12-24-18(22)14-9-5-2-6-10-14/h1-10,15-16,19-20H,11-12H2/t15-,16-/m1/s1
【InChIKey】
InChIKey=DJOUKNAKSJTIKP-HZPDHXFCSA-N
【SMILES】
c1ccc(cc1)C(=O)OC[C@H]([C@@H](COC(=O)c2ccccc2)O)O
【MOL File】
(2R,3R)-2,3-DIHYDROX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(2R,3R)-2,3-DIHYDROXYBUTANE-1,4-DIYL DIBENZOATE.cml