Chemical ID: 4744520

Cc1c(c(c(c(c1C)C)COc2ccccc2C(=O)C)C)C
Chemical ID:
4744520
Name [?]:
1-[2-[(2,3,4,5,6-pentamethylphenyl)methoxy]phenyl]ethanone
SMILES [?]:
Cc1c(c(c(c(c1C)C)COc2ccccc2C(=O)C)C)C
InChi [?]:
InChI=1/C20H24O2/c1-12-13(2)15(4)19(16(5)14(12)3)11-22-20-10-8-7-9-18(20)17(6)21/h7-10H,11H2,1-6H3
InChi Info:
AuxInfo=1/0/N:1,8,22,9,21,20,15,14,16,13,10,2,7,3,6,4,18,17,5,12,19,11/E:(2,3)(4,5)(13,14)(15,16)/rA:22nCCCCCCCCCCOCCCCCCCOCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s5;s10;s11;s12;d13;s14;d15;d12s16;s17;d18;s18;s4;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H24O2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.28924
Area:506.86
Solvation:-4.38226
Coulombic:-14.5573
Bond Count [?]
All:23
Single:16
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:296.403
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.67
LogP (Chemaxon):5.21

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Descriptor Annotations

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