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A 99
CAS: 3033-62-3 | C8H20N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
3033-62-3
Molecular Formula:
C8H20N2O
Molecular Weight:
160.261 g/mol
Names and Synonyms:
A 99
Bis(Dimethylaminoethyl) Ether
Kalpur PC
Niax A 1
Bis[2-(dimethylamino)ethyl] ether
Ethanamine, 2,2′-oxybis[N,N-dimethyl-
Bis(dimethylaminoethyl) ether
Niax A 99
Toyocat ETS
Dabco BL 19I
Dabco BL 19
Toyocat ET
Dabco BL 11
Texacat ZF 20
N,N,N′,N′-Tetramethyl-3-oxapentane-1,5-diamine
1,5-Bis(dimethylamino)-3-oxapentane
Texacat ZF 22
A 133
Minico TMDA
Kaolizer 12P
BL 19
Jeffcat ZM 20
Kaolizer 12
PC CAT NP 99
NP 99
PC CAT NP 133
Jeffcat ZF 20
ZF 20
PC CAT NP 90
NSC 109887
N,N,N′,N′-Tetramethyl-2,2′-oxybis[ethylamine]
Toyocat ET 33B
ET 33B
N,N,N′,N′-Tetramethylbisaminoethyl ether
A 1
BL 11
Niax Catalyst A 1
DY 1
Tetramethyl bis(aminoethyl) ether
Addocat 108
Jeffcat Z 20
NT CAT A 1
BDMAEE
Lupragen N 205
Lupragen 205
2-[2-(Dimethylamino)ethoxy]-N,N-dimethylethanamine
2-(2-Dimethylaminoethoxy)-N,N-dimethyl-ethanamine
Polycat BL 17
ETS
ETS (catalyst)
Ethylamine, 2,2′-oxybis[N,N-dimethyl-
2,2′-Oxybis[N,N-dimethylethanamine]
A 99 (amine)
2,2′-Oxybis[N,N-dimethylethylamine]
Identifiers:
SMILES:
CN(C)CCOCCN(C)C
InChI:
InChI=1S/C8H20N2O/c1-9(2)5-7-11-8-6-10(3)4/h5-8H2,1-4H3
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 |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 160.26 g/mol | Legacy Database |
| density | 0.85 g/cm³ | Legacy Database |
| cas-boiling-point | 70 °C @ Press: 11 Torr None | Legacy Database |
| cas-canonical-smile | O(CCN(C)C)CCN(C)C None | Legacy Database |
| cas-density | 0.8496 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C8H20N2O/c1-9(2)5-7-11-8-6-10(3)4/h5-8H2,1-4H3 None | Legacy Database |
| cas-inchi-key | InChIKey=GTEXIOINCJRBIO-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Bis(dimethylaminoethyl) ether None | Legacy Database |
| LogP | 0.1262000000000003 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 160.261 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 160.15756326 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 11 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 3 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 6 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 15.71 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 47.92700000000003 | RDKit |
