Chemical ID: 6046608

CCCCCCOc1cc(c(c(c1C)C)O)C
Chemical ID:
6046608
Name [?]:
4-hexoxy-2,3,6-trimethyl-phenol
SMILES [?]:
CCCCCCOc1cc(c(c(c1C)C)O)C
InChi [?]:
InChI=1/C15H24O2/c1-5-6-7-8-9-17-14-10-11(2)15(16)13(4)12(14)3/h10,16H,5-9H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,17,14,15,2,3,4,5,6,9,10,13,12,8,11,16,7/rA:17nCCCCCCOCCCCCCCCOC/rB:s1;s2;s3;s4;s5;s6;s7;s8;d9;s10;d11;d8s12;s13;s12;s11;s10;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24O2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.19339
Area:463.86
Solvation:-2.40311
Coulombic:-25.1182
Bond Count [?]
All:17
Single:14
Double:3
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:236.35
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.7
LogP (Chemaxon):4.91

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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