Chemical ID: 5577127

CCCCCCCCCCOc1ccc(cc1)OCCCCCCCCCC
Chemical ID:
5577127
Name [?]:
1-(4-decoxyphenoxy)decane
SMILES [?]:
CCCCCCCCCCOc1ccc(cc1)OCCCCCCCCCC
InChi [?]:
InChI=1/C26H46O2/c1-3-5-7-9-11-13-15-17-23-27-25-19-21-26(22-20-25)28-24-18-16-14-12-10-8-6-4-2/h19-22H,3-18,23-24H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,28,2,27,3,26,4,25,5,24,6,23,7,22,8,21,9,20,13,17,14,16,10,19,12,15,11,18/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20,21,22)(23,24)(25,26)(27,28)/rA:28nCCCCCCCCCCOCCCCCCOCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s11;s12;d13;s14;d15;d12s16;s15;s18;s19;s20;s21;s22;s23;s24;s25;s26;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C26H46O2
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:16.4809
Area:775.769
Solvation:-2.91334
Coulombic:-20.5374
Bond Count [?]
All:28
Single:25
Double:3
Rotors:20
Chiral:0
Rigid Segments:11
Chemical Properties
Molecular Weight:390.642
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:9.9
LogP (Chemaxon):8.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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