56495-82-0
IRISQUINONE
Name
IRISQUINONE
Formula
C24 H38 O3
MolWeight
374.561
1Identification
【Name】
IRISQUINONE
【CAS】
【MDL】
MFCD01734461
【English Synonyms】
【Formula】
C24 H38 O3
【MolWeight】
374.561
【Inchi】
InChI=1S/C24H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19-22(25)20-23(27-2)24(21)26/h8-9,19-20H,3-7,10-18H2,1-2H3/b9-8-
【InChIKey】
InChIKey=YYCCUFKHCNSRIA-HJWRWDBZSA-N
【SMILES】
CCCCCC/C=C\CCCCCCCCCC1=CC(=O)C=C(C1=O)OC
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:8.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
IRISQUINONE.cml
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