Chemical ID: 4944625

COc1ccc(cc1)C=Cc2cc(cc(c2)OC)OC
Chemical ID:
4944625
Name [?]:
1,3-dimethoxy-5-[2-(4-methoxyphenyl)vinyl]benzene
SMILES [?]:
COc1ccc(cc1)C=Cc2cc(cc(c2)OC)OC
InChi [?]:
InChI=1/C17H18O3/c1-18-15-8-6-13(7-9-15)4-5-14-10-16(19-2)12-17(11-14)20-3/h4-12H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,18,20,9,10,5,7,4,8,16,12,14,6,11,3,15,13,2,17,19/E:(2,3)(6,7)(8,9)(10,11)(16,17)(19,20)/rA:20nCOCCCCCCCCCCCCCCOCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;w9;s10;s11;d12;s13;d14;d11s15;s15;s17;s13;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:6.33437
Area:451.828
Solvation:-4.96134
Coulombic:-23.2439
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:270.323
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.4
LogP (Chemaxon):3.51

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Descriptor Annotations

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