Chemical ID: 7039251

Cc1ccc(cc1)C=CC(=O)c2ccc(cc2)OC(=O)c3ccc(cc3)C
Chemical ID:
7039251
Name [?]:
[4-[3-(p-tolyl)prop-2-enoyl]phenyl] 4-methylbenzoate
SMILES [?]:
Cc1ccc(cc1)C=CC(=O)c2ccc(cc2)OC(=O)c3ccc(cc3)C
InChi [?]:
InChI=1/C24H20O3/c1-17-3-7-19(8-4-17)9-16-23(25)20-12-14-22(15-13-20)27-24(26)21-10-5-18(2)6-11-21/h3-16H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,27,3,7,23,25,4,6,8,22,26,13,17,14,16,9,2,24,5,12,21,15,10,19,11,20,18/E:(3,4)(5,6)(7,8)(10,11)(12,13)(14,15)/rA:27nCCCCCCCCCCOCCCCCCOCOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;w8;s9;d10;s10;s12;d13;s14;d15;d12s16;s15;s18;d19;s19;s21;d22;s23;d24;d21s25;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H20O3
All Atoms:47
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:12.5823
Area:615.992
Solvation:-2.81751
Coulombic:-32.0679
Bond Count [?]
All:29
Single:17
Double:12
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:356.414
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:6.22
LogP (Chemaxon):6.18

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