Chemical ID: 4146464

Cc1ccc(cc1C)OC(=O)C=Cc2ccc(c(c2)OC)OC
Chemical ID:
4146464
Name [?]:
(3,4-dimethylphenyl) 3-(3,4-dimethoxyphenyl)prop-2-enoate
SMILES [?]:
Cc1ccc(cc1C)OC(=O)C=Cc2ccc(c(c2)OC)OC
InChi [?]:
InChI=1/C19H20O4/c1-13-5-8-16(11-14(13)2)23-19(20)10-7-15-6-9-17(21-3)18(12-15)22-4/h5-12H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,8,23,21,3,15,13,4,16,12,6,19,2,7,14,5,17,18,10,11,22,20,9/rA:23nCCCCCCCCOCOCCCCCCCCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;w12;s13;s14;d15;s16;d17;d14s18;s18;s20;s17;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H20O4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.34164
Area:510.397
Solvation:-5.41828
Coulombic:-34.1142
Bond Count [?]
All:24
Single:16
Double:8
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:312.36
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.23
LogP (Chemaxon):4.3

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue