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Polyethylene Glycol Bis(2-Aminoethyl) Ether
CAS: 24991-53-5 | C6H16N2O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
24991-53-5
Molecular Formula:
C6H16N2O2
Molecular Weight:
148.206 g/mol
Names and Synonyms:
Polyethylene Glycol Bis(2-Aminoethyl) Ether
ED 220
ED 410
α,ω-Diaminopolyethylene glycol
PEG diamine
PEO 600
Y 20000
Y 10000
Y 4000
JSJ 73-006
Diamino-terminated polyethylene glycol
O,O′-Bis(2-aminoethyl)octadecaethylene glycol
Diamine-PEG 897
Fluka 06703
Tetradecaethylene glycol diamine
PEG 1000 Diamine
Jeffamine 2001
PEO-Amine 400
PEG 4000DCA
Polyethylene glycol bis(2-aminoethyl) ether
Poly(ethylene oxide)diamine
Poly(oxyethylene)diamine
Polyethylene glycol diamine
Ethanol, 2-amino-, diether with polyethylene glycol
Glycols, polyethylene, bis(2-aminoethyl) ether
Poly(oxy-1,2-ethanediyl), α-(2-aminoethyl)-ω-(2-aminoethoxy)-
Identifiers:
SMILES:
NCCOCCOCCN
InChI:
InChI=1S/C6H16N2O2/c7-1-3-9-5-6-10-4-2-8/h1-8H2
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Molecular
Property | Value | Source |
---|---|---|
Molecular Weight | 148.206 g/mol | RDKit |
Exact
Property | Value | Source |
---|---|---|
Exact Molecular Weight | 148.121177752 g/mol | RDKit |
Heavy
Property | Value | Source |
---|---|---|
Heavy Atom Count | 10 count | RDKit |
Hydrogen
Property | Value | Source |
---|---|---|
Hydrogen Bond Acceptors | 4 count | RDKit |
Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
Property | Value | Source |
---|---|---|
Rotatable Bonds | 7 count | RDKit |
Aromatic
Property | Value | Source |
---|---|---|
Aromatic Ring Count | 0 count | RDKit |
Topological
Property | Value | Source |
---|---|---|
Topological Polar Surface Area | 70.5 Ų | RDKit |
Physical Properties
Property | Value | Source |
---|---|---|
LogP | -1.0629999999999982 | RDKit |
molecular_mass | 148.21 g/mol | Legacy Database |
cas-canonical-smile | O(CCOCCN)CCN None | Legacy Database |
cas-inchi | InChI=1S/C6H16N2O2/c7-1-3-9-5-6-10-4-2-8/h1-8H2 None | Legacy Database |
cas-inchi-key | InChIKey=IWBOPFCKHIJFMS-UHFFFAOYSA-N None | Legacy Database |
cas-name | Polyethylene glycol bis(2-aminoethyl) ether None | Legacy Database |
Molar
Property | Value | Source |
---|---|---|
Molar Refractivity | 39.74680000000001 | RDKit |