Chemical ID: 5871711

CCN(CC)CCOc1ccccc1C=O
Chemical ID:
5871711
Name [?]:
2-(2-diethylaminoethoxy)benzaldehyde
SMILES [?]:
CCN(CC)CCOc1ccccc1C=O
InChi [?]:
InChI=1/C13H19NO2/c1-3-14(4-2)9-10-16-13-8-6-5-7-12(13)11-15/h5-8,11H,3-4,9-10H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,2,4,12,11,13,10,6,7,15,14,9,3,16,8/E:(1,2)(3,4)/rA:16nCCNCCCCOCCCCCCCO/rB:s1;s2;s3;s4;s3;s6;s7;s8;s9;d10;s11;d12;d9s13;s14;d15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H19NO2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.49719
Area:432.429
Solvation:-3.31354
Coulombic:-20.6924
Bond Count [?]
All:16
Single:12
Double:4
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:221.296
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.33
LogP (Chemaxon):2.13

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