Chemical ID: 4573338

Cc1ccc(o1)C=C2C(=O)c3ccc(cc3O2)OCc4ccc(cc4)C=C
Chemical ID:
4573338
Name [?]:
2-[(5-methyl-2-furyl)methylene]-6-[(4-vinylphenyl)methoxy]benzofuran-3-one
SMILES [?]:
Cc1ccc(o1)C=C2C(=O)c3ccc(cc3O2)OCc4ccc(cc4)C=C
InChi [?]:
InChI=1/C23H18O4/c1-3-16-5-7-17(8-6-16)14-25-18-10-11-20-21(12-18)27-22(23(20)24)13-19-9-4-15(2)26-19/h3-13H,1,14H2,2H3
InChi Info:
AuxInfo=1/0/N:27,1,26,3,22,24,21,25,4,13,12,15,7,19,2,23,20,14,5,11,16,8,9,10,18,6,17/E:(5,6)(7,8)/rA:27nCCCCCOCCCOCCCCCCOOCCCCCCCCC/rB:s1;d2;s3;d4;s2s5;s5;w7;s8;d9;s9;s11;d12;s13;d14;d11s15;s8s16;s14;s18;s19;s20;d21;s22;d23;d20s24;s23;d26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H18O4
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:9.7897
Area:587.388
Solvation:-4.895
Coulombic:-32.0787
Bond Count [?]
All:30
Single:19
Double:11
Rotors:5
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:358.387
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:5.13
LogP (Chemaxon):4.47

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