Chemical ID: 6659254

COC(=O)c1ccccc1OC(=O)c2ccccc2
Chemical ID:
6659254
Name [?]:
methyl 2-benzoyloxybenzoate
SMILES [?]:
COC(=O)c1ccccc1OC(=O)c2ccccc2
InChi [?]:
InChI=1/C15H12O4/c1-18-15(17)12-9-5-6-10-13(12)19-14(16)11-7-3-2-4-8-11/h2-10H,1H3
InChi Info:
AuxInfo=1/0/N:1,17,16,18,7,8,15,19,6,9,14,5,10,12,3,13,4,2,11/E:(3,4)(7,8)/rA:19nCOCOCCCCCCOCOCCCCCC/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s10;s11;d12;s12;s14;d15;s16;d17;d14s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12O4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.85684
Area:438.267
Solvation:-2.09985
Coulombic:-41.9435
Bond Count [?]
All:20
Single:12
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:256.253
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.46
LogP (Chemaxon):2.82

Name Annotations

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Descriptor Annotations

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