Chemical ID: 5854866

Cc1ccc(c(c1)OC(=O)C=Cc2ccc(c(c2)OC)OC)C
Chemical ID:
5854866
Name [?]:
(2,5-dimethylphenyl) 3-(3,4-dimethoxyphenyl)prop-2-enoate
SMILES [?]:
Cc1ccc(c(c1)OC(=O)C=Cc2ccc(c(c2)OC)OC)C
InChi [?]:
InChI=1/C19H20O4/c1-13-5-6-14(2)17(11-13)23-19(20)10-8-15-7-9-16(21-3)18(12-15)22-4/h5-12H,1-4H3
InChi Info:
AuxInfo=1/0/N:1,23,22,20,3,4,14,12,15,11,7,18,2,5,13,16,6,17,9,10,21,19,8/rA:23nCCCCCCCOCOCCCCCCCCOCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;w11;s12;s13;d14;s15;d16;d13s17;s17;s19;s16;s21;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H20O4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.21573
Area:504.178
Solvation:-5.38873
Coulombic:-34.3009
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:4.02
LogP (Chemaxon):4.3

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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