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Chemical ID: 6492127
Chemical ID:
6492127
Name [?]:
2-[2-[2-(2-hydroxyethoxy)ethyl-phenyl-amino]ethoxy]ethanol
SMILES [?]:
c1ccc(cc1)N(CCOCCO)CCOCCO
InChi [?]:
InChI=1/C14H23NO4/c16-8-12-18-10-6-15(7-11-19-13-9-17)14-4-2-1-3-5-14/h1-5,16-17H,6-13H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,8,14,12,18,9,15,11,17,4,7,13,19,10,16/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)(16,17)(18,19)/rA:19nCCCCCCNCCOCCOCCOCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;s12;s7;s14;s15;s16;s17;s18;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H23NO4 |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 4.50144 |
Area: | 501.583 |
Solvation: | -8.03815 |
Coulombic: | -53.7321 |
Bond Count [?]
All: | 19 |
Single: | 16 |
Double: | 3 |
Rotors: | 11 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 269.337 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 5 |
XLogP: | 0.43 |
LogP (Chemaxon): | 1.1 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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