Chemical ID: 4914544

c1cc(cc(c1)N(CCO)CCO)N(CCO)CCO
Chemical ID:
4914544
Name [?]:
2-[[3-[bis(2-hydroxyethyl)amino]phenyl]-(2-hydroxyethyl)amino]ethanol
SMILES [?]:
c1cc(cc(c1)N(CCO)CCO)N(CCO)CCO
InChi [?]:
InChI=1/C14H24N2O4/c17-8-4-15(5-9-18)13-2-1-3-14(12-13)16(6-10-19)7-11-20/h1-3,12,17-20H,4-11H2
InChi Info:
AuxInfo=1/0/N:1,2,6,15,18,8,11,16,19,9,12,4,3,5,14,7,17,20,10,13/E:(2,3)(4,5,6,7)(8,9,10,11)(13,14)(15,16)(17,18,19,20)/rA:20nCCCCCCNCCOCCONCCOCCO/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s7;s11;s12;s3;s14;s15;s16;s14;s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H24N2O4
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:5.47172
Area:489.703
Solvation:-6.77085
Coulombic:-77.5636
Bond Count [?]
All:20
Single:17
Double:3
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:284.351
H-Bond Donors:4
H-Bond Acceptors:6
XLogP:-0.4
LogP (Chemaxon):0.8

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