84434-52-6
4-METHYLUMBELLIFERYL LIGNOCERATE
Name
4-METHYLUMBELLIFERYL LIGNOCERATE
Formula
C34 H54 O4
MolWeight
526.797
1Identification
【Name】
4-METHYLUMBELLIFERYL LIGNOCERATE
【CAS】
【MDL】
MFCD00051229
【English Synonyms】
【Formula】
C34 H54 O4
【MolWeight】
526.797
【Inchi】
InChI=1S/C34H54O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-33(35)37-30-25-26-31-29(2)27-34(36)38-32(31)28-30/h25-28H,3-24H2,1-2H3
【InChIKey】
InChIKey=BBJLPGKQHTUSCG-UHFFFAOYSA-N
【SMILES】
CCCCCCCCCCCCCCCCCCCCCCCC(=O)Oc1ccc2c(cc(=O)oc2c1)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:13.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
Chem-Impex International, Inc. :4-METHYLUMBELLIFERYL LIGNOCERATE
4CML File
4-METHYLUMBELLIFERYL LIGNOCERATE.cml
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Country/Region:Hong Kong
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