55101-94-5
8-ETHYL-A-PENTYL-2-OXOCANEMETHANOL ACETATE
Name8-ETHYL-A-PENTYL-2-OXOCANEMETHANOL ACETATE
1Identification
【Name】
8-ETHYL-A-PENTYL-2-OXOCANEMETHANOL ACETATE
【CAS】
【MDL】
MFCD21608964
【English Synonyms】
【Formula】
C17 H32 O3
【MolWeight】
284.437
【Inchi】
InChI=1S/C17H32O3/c1-4-6-8-12-16(19-14(3)18)17-13-10-7-9-11-15(5-2)20-17/h15-17H,4-13H2,1-3H3
【InChIKey】
InChIKey=BFAHOCKAGNOUBY-UHFFFAOYSA-N
【SMILES】
CCCCCC(C1CCCCCC(O1)CC)OC(=O)C
【MOL File】
8-ETHYL-A-PENTYL-2-O….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
8-ETHYL-A-PENTYL-2-OXOCANEMETHANOL ACETATE.cml