Chemical ID: 4372038

Cc1ccc(c(c1)OCCOc2ccccc2OC)C(C)C
Chemical ID:
4372038
Name [?]:
1-isopropyl-2-[2-(2-methoxyphenoxy)ethoxy]-4-methyl-benzene
SMILES [?]:
Cc1ccc(c(c1)OCCOc2ccccc2OC)C(C)C
InChi [?]:
InChI=1/C19H24O3/c1-14(2)16-10-9-15(3)13-19(16)22-12-11-21-18-8-6-5-7-17(18)20-4/h5-10,13-14H,11-12H2,1-4H3
InChi Info:
AuxInfo=1/0/N:21,22,1,19,15,14,16,13,3,4,10,9,7,20,2,5,17,12,6,18,11,8/E:(1,2)/rA:22nCCCCCCCOCCOCCCCCCOCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;s11;s12;d13;s14;d15;d12s16;s17;s18;s5;s20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H24O3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:7.31405
Area:534.361
Solvation:-6.04497
Coulombic:-23.4874
Bond Count [?]
All:23
Single:17
Double:6
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:300.392
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.81
LogP (Chemaxon):4.82

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Descriptor Annotations

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