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CAS No.: | 10563-27-6 |
---|---|
Name: | N,N'-Bis(2-Hydroxyethyl)propane-1,3-diamine |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C7H18N2O2 |
Molecular Weight: | 162.232 |
Synonyms: | 2,2'-(1,3-propanediyldiimino)bisethanol;2,2'-(Propan-1,3-diyldiimino)diethanol; |
Density: | 1.035 g/cm3 |
Boiling Point: | 317.6 °C at 760 mmHg |
Flash Point: | 140 °C |
PSA: | 64.52000 |
LogP: | -0.67790 |
oxirane
Trimethylenediamine
A
2-[(3-aminopropyl)amino]ethanol
B
N,N'-bis(2-hydroxyethyl)-1,3-propanediamine
Conditions | Yield |
---|---|
In methanol at 0℃; | A 60% B 20% |
ethanolamine
1,3-dibromo-propane
N,N'-bis(2-hydroxyethyl)-1,3-propanediamine
Conditions | Yield |
---|---|
With sodium carbonate In ethanol for 16h; Heating; | 36% |
N,N'-bis(2-hydroxyethyl)-1,3-propanediamine
2-Chloro-N-[3-(2-chloro-acetylamino)-propyl]-N-methyl-acetamide
4,8-Bis-(2-hydroxy-ethyl)-1-methyl-1,4,8,11-tetraaza-cyclotetradecane-2,10-dione
Conditions | Yield |
---|---|
With sodium carbonate In N,N-dimethyl-formamide; acetonitrile Heating; | 54% |
2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile
N,N'-bis(2-hydroxyethyl)-1,3-propanediamine
Conditions | Yield |
---|---|
In tetrahydrofuran for 12h; Ambient temperature; | 53% |
N,N'-bis(2-hydroxyethyl)-1,3-propanediamine
Conditions | Yield |
---|---|
With thionyl chloride In acetonitrile |
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 54 percent / Na2CO3 / acetonitrile; dimethylformamide / Heating 2: 1) 1 M B2H6, 2) 18percent aq. HCl / 1) THF, reflux, 2) a) room temp., b) 80-100 deg C, 15 min View Scheme |
Conditions | Yield |
---|---|
With formic acid In methanol; water at 70℃; for 4h; |
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The CAS register number of N,N'-Bis(2-Hydroxyethyl)propane-1,3-diamine is 10563-27-6. It also can be called as 2,2'-(1,3-propanediyldiimino)bisethanol and the systematic name about this chemical is 2,2'-(propane-1,3-diyldiimino)diethanol. The molecular formula about this chemical is C7H18N2O2 and the molecular weight is 162.23. It belongs to the following product categorie which includes Hydroxyethylamines.
Physical properties about N,N'-Bis(2-Hydroxyethyl)propane-1,3-diamine are: (1)ACD/LogP: -1.63; (2)#H bond acceptors: 4; (3)#H bond donors: 4; (4)#Freely Rotating Bonds: 10; (5)Polar Surface Area: 24.94 Å2; (6)Index of Refraction: 1.482; (7)Molar Refractivity: 44.73 cm3; (8)Molar Volume: 156.7 cm3; (9)Polarizability: 17.73x10-24cm3; (10)Surface Tension: 42.4 dyne/cm; (11)Density: 1.035 g/cm3; (12)Flash Point: 140 °C; (13)Enthalpy of Vaporization: 64.81 kJ/mol; (14)Boiling Point: 317.6 °C at 760 mmHg; (15)Vapour Pressure: 3.18E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: OCCNCCCNCCO
(2)InChI: InChI=1/C7H18N2O2/c10-6-4-8-2-1-3-9-5-7-11/h8-11H,1-7H2
(3)InChIKey: XDSBMMZQOKZFQI-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C7H18N2O2/c10-6-4-8-2-1-3-9-5-7-11/h8-11H,1-7H2
(5)Std. InChIKey: XDSBMMZQOKZFQI-UHFFFAOYSA-N