Chemical ID: 4345768

Cc1cc(=O)oc2c1cc3c(coc3c2)C
Chemical ID:
4345768
Name [?]:
None
SMILES [?]:
Cc1cc(=O)oc2c1cc3c(coc3c2)C
InChi [?]:
InChI=1/C13H10O3/c1-7-3-13(14)16-12-5-11-10(4-9(7)12)8(2)6-15-11/h3-6H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,16,3,9,15,12,2,11,8,10,14,7,4,5,13,6/rA:16nCCCCOOCCCCCCOCCC/rB:s1;d2;s3;d4;s4;s6;s2s7;d8;s9;s10;d11;s12;d10s13;d7s14;s11;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H10O3
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:6.46066
Area:373.952
Solvation:-2.88814
Coulombic:-25.1722
Bond Count [?]
All:18
Single:12
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:214.217
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.32
LogP (Chemaxon):3.63

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Descriptor Annotations

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