Chemical ID: 6426509

c1ccc(cc1)c2c(c-3c(oc2=O)CCc4c3cccc4)O
Chemical ID:
6426509
Name [?]:
None
SMILES [?]:
c1ccc(cc1)c2c(c-3c(oc2=O)CCc4c3cccc4)O
InChi [?]:
InChI=1/C19H14O3/c20-18-16(13-7-2-1-3-8-13)19(21)22-15-11-10-12-6-4-5-9-14(12)17(15)18/h1-9,20H,10-11H2
InChi Info:
AuxInfo=1/0/N:1,2,6,20,19,21,3,5,18,15,14,16,4,17,10,7,9,8,12,22,13,11/E:(2,3)(7,8)/rA:22nCCCCCCCCCCOCOCCCCCCCCO/rB:s1;d2;s3;d4;d1s5;s4;d7;s8;d9;s10;s7s11;d12;s10;s14;s15;s9s16;d17;s18;d19;d16s20;s8;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H14O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.5919
Area:454.787
Solvation:-2.77776
Coulombic:-37.1507
Bond Count [?]
All:25
Single:16
Double:9
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:290.313
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.96
LogP (Chemaxon):4.5

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Descriptor Annotations

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