3265-58-5
2,6-DIMETHYL-4-OXO-4H-PYRAN-3-CARBOXYLIC ACID
Name2,6-DIMETHYL-4-OXO-4H-PYRAN-3-CARBOXYLIC ACID
1Identification
【Name】
2,6-DIMETHYL-4-OXO-4H-PYRAN-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD00202218
【English Synonyms】
【Formula】
C8 H8 O4
【MolWeight】
168.147
【Inchi】
InChI=1S/C8H8O4/c1-4-3-6(9)7(8(10)11)5(2)12-4/h3H,1-2H3,(H,10,11)
【InChIKey】
InChIKey=MZMRFDKQPOMOGX-UHFFFAOYSA-N
【SMILES】
Cc1cc(=O)c(c(o1)C)C(=O)O
【MOL File】
2,6-DIMETHYL-4-OXO-4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,6-DIMETHYL-4-OXO-4H-PYRAN-3-CARBOXYLIC ACID.cml