Chemical ID: 7520406

Cc1cccc(c1O)C(=O)OCc2ccc(cc2)C(=O)c3ccccc3
Chemical ID:
7520406
Name [?]:
(4-benzoylphenyl)methyl 2-hydroxy-3-methyl-benzoate
SMILES [?]:
Cc1cccc(c1O)C(=O)OCc2ccc(cc2)C(=O)c3ccccc3
InChi [?]:
InChI=1/C22H18O4/c1-15-6-5-9-19(20(15)23)22(25)26-14-16-10-12-18(13-11-16)21(24)17-7-3-2-4-8-17/h2-13,23H,14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,24,23,25,4,3,22,26,5,14,18,15,17,12,2,13,21,16,6,7,19,9,8,20,10,11/E:(3,4)(7,8)(10,11)(12,13)/rA:26nCCCCCCCOCOOCCCCCCCCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;d9;s9;s11;s12;s13;d14;s15;d16;d13s17;s16;d19;s19;s21;d22;s23;d24;d21s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H18O4
All Atoms:44
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:10.6565
Area:576.148
Solvation:-3.74716
Coulombic:-48.0946
Bond Count [?]
All:28
Single:17
Double:11
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:6.02
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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