52946-22-2
D,L-1'-ACETOXYCHAVICOL ACETATE
Name
D,L-1'-ACETOXYCHAVICOL ACETATE
Formula
C13 H14 O4
MolWeight
234.25
1Identification
【Name】
D,L-1'-ACETOXYCHAVICOL ACETATE
【CAS】
【MDL】
MFCD01632488
【English Synonyms】
【Formula】
C13 H14 O4
【MolWeight】
234.25
【Inchi】
InChI=1S/C13H14O4/c1-4-13(17-10(3)15)11-5-7-12(8-6-11)16-9(2)14/h4-8,13H,1H2,2-3H3
【InChIKey】
InChIKey=JAMQIUWGGBSIKZ-UHFFFAOYSA-N
【SMILES】
CC(=O)Oc1ccc(cc1)C(C=C)OC(=O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
D,L-1'-ACETOXYCHAVICOL ACETATE.cml
Quick Release
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