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Chemical ID: 7656113
Chemical ID:
7656113
Name [?]:
None
SMILES [?]:
COC(=O)c1cccc(c1F)C(=O)OC
InChi [?]:
InChI=1/C10H9FO4/c1-14-9(12)6-4-3-5-7(8(6)11)10(13)15-2/h3-5H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,15,7,6,8,5,9,10,3,12,11,4,13,2,14/E:(1,2)(4,5)(6,7)(9,10)(12,13)(14,15)/rA:15nCOCOCCCCCCFCOOC/rB:s1;s2;d3;s3;s5;d6;s7;d8;d5s9;s10;s9;d12;s12;s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H9FO4 |
All Atoms: | 24 |
Heavy Atoms: | 15 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 5.3553 |
Area: | 377.11 |
Solvation: | -4.07244 |
Coulombic: | -41.2297 |
Bond Count [?]
All: | 15 |
Single: | 10 |
Double: | 5 |
Rotors: | 4 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 2.06 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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