Chemical ID: 7513032

COc1ccc(cc1)OCCCOc2ccccc2
Chemical ID:
7513032
Name [?]:
1-methoxy-4-(3-phenoxypropoxy)benzene
SMILES [?]:
COc1ccc(cc1)OCCCOc2ccccc2
InChi [?]:
InChI=1/C16H18O3/c1-17-14-8-10-16(11-9-14)19-13-5-12-18-15-6-3-2-4-7-15/h2-4,6-11H,5,12-13H2,1H3
InChi Info:
AuxInfo=1/0/N:1,17,16,18,11,15,19,4,8,5,7,12,10,3,14,6,2,13,9/E:(3,4)(6,7)(8,9)(10,11)/rA:19nCOCCCCCCOCCCOCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;s11;s12;s13;s14;d15;s16;d17;d14s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H18O3
All Atoms:37
Heavy Atoms:19
Chiral Atoms:None
ZAP Information [?]
Total:7.23236
Area:480.542
Solvation:-4.78118
Coulombic:-23.4133
Bond Count [?]
All:20
Single:14
Double:6
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.94
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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