5923-14-8
2,3,6,7-TETRAMETHYLOCT-4-YNE-2,3,6,7-TETROL
Name2,3,6,7-TETRAMETHYLOCT-4-YNE-2,3,6,7-TETROL
1Identification
【Name】
2,3,6,7-TETRAMETHYLOCT-4-YNE-2,3,6,7-TETROL
【CAS】
【MDL】
MFCD18974901
【English Synonyms】
【Formula】
C12 H22 O4
【MolWeight】
230.302
【Inchi】
InChI=1S/C12H22O4/c1-9(2,13)11(5,15)7-8-12(6,16)10(3,4)14/h13-16H,1-6H3
【InChIKey】
InChIKey=BJEXWJSWDHTAHH-UHFFFAOYSA-N
【SMILES】
CC(C)(C(C)(C#CC(C)(C(C)(C)O)O)O)O
【MOL File】
2,3,6,7-TETRAMETHYLO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:4
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,3,6,7-TETRAMETHYLOCT-4-YNE-2,3,6,7-TETROL.cml