Chemical ID: 4253957

COc1ccc(cc1OCCN2CCOCC2)C=O
Chemical ID:
4253957
Name [?]:
4-methoxy-3-(2-morpholinoethoxy)benzaldehyde
SMILES [?]:
COc1ccc(cc1OCCN2CCOCC2)C=O
InChi [?]:
InChI=1/C14H19NO4/c1-17-13-3-2-12(11-16)10-14(13)19-9-6-15-4-7-18-8-5-15/h2-3,10-11H,4-9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,5,4,13,17,11,14,16,10,7,18,6,3,8,12,19,2,15,9/E:(4,5)(7,8)/rA:19nCOCCCCCCOCCNCCOCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s10;s11;s12;s13;s14;s15;s12s16;s6;d18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H19NO4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:3.87256
Area:468.006
Solvation:-7.82759
Coulombic:-32.5657
Bond Count [?]
All:20
Single:16
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:265.305
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:0.73
LogP (Chemaxon):0.85

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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