Chemical ID: 7346430

c1cc(cc(c1)O)C=C2C(=O)c3ccc(cc3O2)O
Chemical ID:
7346430
Name [?]:
6-hydroxy-2-[(3-hydroxyphenyl)methylene]benzofuran-3-one
SMILES [?]:
c1cc(cc(c1)O)C=C2C(=O)c3ccc(cc3O2)O
InChi [?]:
InChI=1/C15H10O4/c16-10-3-1-2-9(6-10)7-14-15(18)12-5-4-11(17)8-13(12)19-14/h1-8,16-17H
InChi Info:
AuxInfo=1/0/N:1,2,6,14,13,4,8,16,3,5,15,12,17,9,10,7,19,11,18/rA:19nCCCCCCOCCCOCCCCCCOO/rB:s1;d2;s3;d4;d1s5;s5;s3;w8;s9;d10;s10;s12;d13;s14;d15;d12s16;s9s17;s15;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H10O4
All Atoms:29
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.2643
Area:435.146
Solvation:-3.61434
Coulombic:-49.9698
Bond Count [?]
All:21
Single:13
Double:8
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:254.238
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:2.4
LogP (Chemaxon):2.76

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Descriptor Annotations

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