Chemical ID: 7039236

Cc1ccc(cc1)C(=O)C=Cc2cccc(c2)OC(=O)C3CCCCC3
Chemical ID:
7039236
Name [?]:
[3-[3-oxo-3-(p-tolyl)prop-1-enyl]phenyl] cyclohexanecarboxylate
SMILES [?]:
Cc1ccc(cc1)C(=O)C=Cc2cccc(c2)OC(=O)C3CCCCC3
InChi [?]:
InChI=1/C23H24O3/c1-17-10-13-19(14-11-17)22(24)15-12-18-6-5-9-21(16-18)26-23(25)20-7-3-2-4-8-20/h5-6,9-16,20H,2-4,7-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,24,23,25,14,13,22,26,15,3,7,11,4,6,10,17,2,12,5,21,16,8,19,9,20,18/E:(3,4)(7,8)(10,11)(13,14)/rA:26nCCCCCCCCOCCCCCCCCOCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s8;w10;s11;s12;d13;s14;d15;d12s16;s16;s18;d19;s19;s21;s22;s23;s24;s21s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H24O3
All Atoms:50
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:12.1146
Area:599.395
Solvation:-2.87032
Coulombic:-30.1834
Bond Count [?]
All:28
Single:19
Double:9
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:348.435
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:5.98
LogP (Chemaxon):5.85

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