Chemical ID: 5059078

CCc1c(c(c(c(c1C(=O)C)C)C)C)C
Chemical ID:
5059078
Name [?]:
1-(2-ethyl-3,4,5,6-tetramethyl-phenyl)ethanone
SMILES [?]:
CCc1c(c(c(c(c1C(=O)C)C)C)C)C
InChi [?]:
InChI=1/C14H20O/c1-7-13-10(4)8(2)9(3)11(5)14(13)12(6)15/h7H2,1-6H3
InChi Info:
AuxInfo=1/0/N:1,14,13,15,12,11,2,5,6,4,7,9,3,8,10/rA:15nCCCCCCCCCOCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;s9;s7;s6;s5;s4;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H20O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.87153
Area:382.649
Solvation:-1.69468
Coulombic:-8.25602
Bond Count [?]
All:15
Single:11
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:204.308
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.51
LogP (Chemaxon):4.09

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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