565434-20-0
2(5H)-FURANONE, 5-HYDROXY-3-[(1S)-1-HYDROXYETHYL]-4-METHYL-
Name2(5H)-FURANONE, 5-HYDROXY-3-[(1S)-1-HYDROXYETHYL]-4-METHYL-
1Identification
【Name】
2(5H)-FURANONE, 5-HYDROXY-3-[(1S)-1-HYDROXYETHYL]-4-METHYL-
【CAS】
【MDL】
MFCD18811688
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C7 H10 O4
【pro_molWeight】
158.152
【Inchi】
InChI=1S/C7H10O4/c1-3-5(4(2)8)7(10)11-6(3)9/h4,6,8-9H,1-2H3/t4-,6?/m0/s1
【InChIKey】
InChIKey=IILOCLZNWNMJJN-VKZKZBKNSA-N
【SMILES】
CC1=C(C(=O)OC1O)[C@H](C)O
【MOL File】
2(5H)-FURANONE, 5-HY….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:4
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2(5H)-FURANONE, 5-HYDROXY-3-[(1S)-1-HYDROXYETHYL]-4-METHYL-.cml