Chemical ID: 6879608

Cc1ccc2c(c1)c(=O)c(c(o2)c3ccc(cc3)OC)OC(=O)C
Chemical ID:
6879608
Name [?]:
[2-(4-methoxyphenyl)-6-methyl-4-oxo-chromen-3-yl] acetate
SMILES [?]:
Cc1ccc2c(c1)c(=O)c(c(o2)c3ccc(cc3)OC)OC(=O)C
InChi [?]:
InChI=1/C19H16O5/c1-11-4-9-16-15(10-11)17(21)19(23-12(2)20)18(24-16)13-5-7-14(22-3)8-6-13/h4-10H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,24,20,3,14,18,15,17,4,7,2,22,13,16,6,5,8,11,10,23,9,19,21,12/E:(5,6)(7,8)/rA:24nCCCCCCCCOCCOCCCCCCOCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;d10;s5s11;s11;s13;d14;s15;d16;d13s17;s16;s19;s10;s21;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H16O5
All Atoms:40
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.70865
Area:514.363
Solvation:-4.15044
Coulombic:-42.8752
Bond Count [?]
All:26
Single:17
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:324.327
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.09
LogP (Chemaxon):3.33

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Descriptor Annotations

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