Chemical ID: 7039371

Cc1ccc(cc1)C(=O)C=Cc2cccc(c2)OC(=O)c3cccc(c3)OC
Chemical ID:
7039371
Name [?]:
[3-[3-oxo-3-(p-tolyl)prop-1-enyl]phenyl] 3-methoxybenzoate
SMILES [?]:
Cc1ccc(cc1)C(=O)C=Cc2cccc(c2)OC(=O)c3cccc(c3)OC
InChi [?]:
InChI=1/C24H20O4/c1-17-9-12-19(13-10-17)23(25)14-11-18-5-3-8-22(15-18)28-24(26)20-6-4-7-21(16-20)27-2/h3-16H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,28,14,23,13,22,24,15,3,7,11,4,6,10,17,26,2,12,5,21,25,16,8,19,9,20,27,18/E:(9,10)(12,13)/rA:28nCCCCCCCCOCCCCCCCCOCOCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s8;w10;s11;s12;d13;s14;d15;d12s16;s16;s18;d19;s19;s21;d22;s23;d24;d21s25;s25;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H20O4
All Atoms:48
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:11.5435
Area:630.822
Solvation:-4.22702
Coulombic:-38.3616
Bond Count [?]
All:30
Single:18
Double:12
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:372.413
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:5.7
LogP (Chemaxon):5.46

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