Chemical ID: 7039321

Cc1ccc(cc1)C=CC(=O)c2ccc(cc2)OC(=O)C=Cc3ccccc3
Chemical ID:
7039321
Name [?]:
[4-[3-(p-tolyl)prop-2-enoyl]phenyl] 3-phenylprop-2-enoate
SMILES [?]:
Cc1ccc(cc1)C=CC(=O)c2ccc(cc2)OC(=O)C=Cc3ccccc3
InChi [?]:
InChI=1/C25H20O3/c1-19-7-9-21(10-8-19)11-17-24(26)22-13-15-23(16-14-22)28-25(27)18-12-20-5-3-2-4-6-20/h2-18H,1H3
InChi Info:
AuxInfo=1/0/N:1,26,25,27,24,28,3,7,4,6,8,22,13,17,14,16,9,21,2,23,5,12,15,10,19,11,20,18/E:(3,4)(5,6)(7,8)(9,10)(13,14)(15,16)/rA:28nCCCCCCCCCCOCCCCCCOCOCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;w8;s9;d10;s10;s12;d13;s14;d15;d12s16;s15;s18;d19;s19;w21;s22;s23;d24;s25;d26;d23s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C25H20O3
All Atoms:48
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:12.7636
Area:637.896
Solvation:-3.18385
Coulombic:-31.994
Bond Count [?]
All:30
Single:17
Double:13
Rotors:7
Chiral:2
Rigid Segments:7
Chemical Properties
Molecular Weight:368.424
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:6.06
LogP (Chemaxon):6.3

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