Chemical ID: 4178628

CCOc1cc(ccc1OC)CN2CCOCC2
Chemical ID:
4178628
Name [?]:
4-[(3-ethoxy-4-methoxy-phenyl)methyl]morpholine
SMILES [?]:
CCOc1cc(ccc1OC)CN2CCOCC2
InChi [?]:
InChI=1/C14H21NO3/c1-3-18-14-10-12(4-5-13(14)16-2)11-15-6-8-17-9-7-15/h4-5,10H,3,6-9,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,2,7,8,14,18,15,17,5,12,6,9,4,13,10,16,3/E:(6,7)(8,9)/rA:18nCCOCCCCCCOCCNCCOCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s6;s12;s13;s14;s15;s16;s13s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21NO3
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:5.3732
Area:449.339
Solvation:-5.86027
Coulombic:-27.3398
Bond Count [?]
All:19
Single:16
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:251.321
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.36
LogP (Chemaxon):1.43

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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