Chemical ID: 4402893

Cc1ccc(cc1)C=CC(=O)c2ccc(cc2OC(=O)c3ccccc3)OC
Chemical ID:
4402893
Name [?]:
[5-methoxy-2-[3-(p-tolyl)prop-2-enoyl]phenyl] benzoate
SMILES [?]:
Cc1ccc(cc1)C=CC(=O)c2ccc(cc2OC(=O)c3ccccc3)OC
InChi [?]:
InChI=1/C24H20O4/c1-17-8-10-18(11-9-17)12-15-22(25)21-14-13-20(27-2)16-23(21)28-24(26)19-6-4-3-5-7-19/h3-16H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,28,24,23,25,22,26,3,7,4,6,8,14,13,9,16,2,5,21,15,12,10,17,19,11,20,27,18/E:(4,5)(6,7)(8,9)(10,11)/rA:28nCCCCCCCCCCOCCCCCCOCOCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;w8;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;s18;d19;s19;s21;d22;s23;d24;d21s25;s15;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H20O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:9.87253
Area:577.408
Solvation:-4.56267
Coulombic:-37.3936
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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