Chemical ID: 6047387

CCOc1ccccc1OC(c2ccccc2)C3CNCCO3
Chemical ID:
6047387
Name [?]:
2-[(2-ethoxyphenoxy)-phenyl-methyl]morpholine
SMILES [?]:
CCOc1ccccc1OC(c2ccccc2)C3CNCCO3
InChi [?]:
InChI=1/C19H23NO3/c1-2-21-16-10-6-7-11-17(16)23-19(15-8-4-3-5-9-15)18-14-20-12-13-22-18/h3-11,18-20H,2,12-14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,15,14,16,6,7,13,17,5,8,21,22,19,12,4,9,18,11,20,3,23,10/E:(4,5)(8,9)/rA:23cCCOCCCCCCOCCCCCCCCCNCCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s11;s12;d13;s14;d15;d12s16;s11;s18;s19;s20;s21;s18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H23NO3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:2
ZAP Information [?]
Total:8.00704
Area:514.321
Solvation:-4.85097
Coulombic:-35.5407
Bond Count [?]
All:25
Single:19
Double:6
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:313.391
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.07
LogP (Chemaxon):3.08

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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