Chemical ID: 6047566

COc1ccc(cc1O)C=Cc2cc(cc(c2)OC)OC
Chemical ID:
6047566
Name [?]:
5-[2-(3,5-dimethoxyphenyl)vinyl]-2-methoxy-phenol
SMILES [?]:
COc1ccc(cc1O)C=Cc2cc(cc(c2)OC)OC
InChi [?]:
InChI=1/C17H18O4/c1-19-14-8-13(9-15(11-14)20-2)5-4-12-6-7-17(21-3)16(18)10-12/h4-11,18H,1-3H3
InChi Info:
AuxInfo=1/0/N:19,21,1,10,11,5,4,17,13,7,15,6,12,16,14,8,3,9,18,20,2/E:(1,2)(8,9)(14,15)(19,20)/rA:21nCOCCCCCCOCCCCCCCCOCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s6;w10;s11;s12;d13;s14;d15;d12s16;s16;s18;s14;s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18O4
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:5.54052
Area:465.638
Solvation:-6.10043
Coulombic:-38.7829
Bond Count [?]
All:22
Single:15
Double:7
Rotors:5
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:286.322
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.99
LogP (Chemaxon):3.22

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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