Chemical ID: 5246797

CC(=O)Oc1ccc(cc1)C(=O)c2ccc(cc2)C(=O)c3ccc(cc3)OC(=O)C
Chemical ID:
5246797
Name [?]:
[4-[4-(4-acetoxybenzoyl)benzoyl]phenyl] acetate
SMILES [?]:
CC(=O)Oc1ccc(cc1)C(=O)c2ccc(cc2)C(=O)c3ccc(cc3)OC(=O)C
InChi [?]:
InChI=1/C24H18O6/c1-15(25)29-21-11-7-19(8-12-21)23(27)17-3-5-18(6-4-17)24(28)20-9-13-22(14-10-20)30-16(2)26/h3-14H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,30,14,18,15,17,7,9,22,26,6,10,23,25,2,28,13,16,8,21,5,24,11,19,3,29,12,20,4,27/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12,13,14)(15,16)(17,18)(19,20)(21,22)(23,24)(25,26)(27,28)(29,30)/rA:30nCCOOCCCCCCCOCCCCCCCOCCCCCCOCOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;d11;s11;s13;d14;s15;d16;d13s17;s16;d19;s19;s21;d22;s23;d24;d21s25;s24;s27;d28;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H18O6
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:11.0317
Area:645.754
Solvation:-5.11209
Coulombic:-53.4047
Bond Count [?]
All:32
Single:19
Double:13
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:402.396
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.7
LogP (Chemaxon):3.49

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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