17245-25-9
COUMURRAYIN
Name
COUMURRAYIN
Formula
C16 H18 O4
MolWeight
274.314
1Identification
【Name】
COUMURRAYIN
【CAS】
【MDL】
MFCD20274605
【English Synonyms】
【Formula】
C16 H18 O4
【MolWeight】
274.314
【Inchi】
InChI=1S/C16H18O4/c1-10(2)5-6-11-13(18-3)9-14(19-4)12-7-8-15(17)20-16(11)12/h5,7-9H,6H2,1-4H3
【InChIKey】
InChIKey=CPXPWRXPEOMRNV-UHFFFAOYSA-N
【SMILES】
CC(=CCc1c(cc(c2c1oc(=O)cc2)OC)OC)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
COUMURRAYIN.cml
Quick Release
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