Chemical ID: 4676609

c1cc(ccc1C=C2C(=O)c3ccc(cc3O2)O)O
Chemical ID:
4676609
Name [?]:
6-hydroxy-2-[(4-hydroxyphenyl)methylene]benzofuran-3-one
SMILES [?]:
c1cc(ccc1C=C2C(=O)c3ccc(cc3O2)O)O
InChi [?]:
InChI=1/C15H10O4/c16-10-3-1-9(2-4-10)7-14-15(18)12-6-5-11(17)8-13(12)19-14/h1-8,16-17H
InChi Info:
AuxInfo=1/0/N:1,5,2,4,13,12,7,15,6,3,14,11,16,8,9,19,18,10,17/E:(1,2)(3,4)/rA:19nCCCCCCCCCOCCCCCCOOO/rB:s1;d2;s3;d4;d1s5;s6;w7;s8;d9;s9;s11;d12;s13;d14;d11s15;s8s16;s14;s3;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H10O4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:6.89456
Area:423.695
Solvation:-3.69783
Coulombic:-49.7417
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:2.82
LogP (Chemaxon):2.76

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Descriptor Annotations

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