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CAS No.: | 3236-54-2 |
---|---|
Name: | 2,4,4-trimethylhexane-1,6-diamine |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C9H22N2 |
Molecular Weight: | 158.287 |
Synonyms: | 2,4,4-Trimethyl-1,6-hexanediamine;2,4,4-Trimethylhexamethylene-1,6-diamine;2,4,4-Trimethylhexamethylenediamine;2,4,4-trimethylhexane-1,6-diamine;2,4,4-trimethylhexane-1,6-diamine; |
EINECS: | 221-793-1 |
Density: | 0.856 g/cm3 |
Boiling Point: | 224.1 °C at 760 mmHg |
Flash Point: | 102.4 °C |
Transport Information: | UN 2327 |
PSA: | 52.04000 |
LogP: | 2.74690 |
2,4,4-Trimethyl-adiponitril
2,2,4-Trimethyl-adiponitril
A
2,2,4-trimethylhexamethylenediamine
B
2,4,4-trimethylhexamethylenediamine
Conditions | Yield |
---|---|
With ammonia; hydrogen; Raney-type cobalt catalyst at 120℃; under 187519 Torr; for 6h; Product distribution / selectivity; | |
With ammonia; hydrogen; Raney-type cobalt catalyst at 120℃; under 187519 Torr; for 6h; Product distribution / selectivity; |
2,2,4-trimethylhexamethylenediamine
2,4,4-trimethylhexamethylenediamine
Hexamethylene diisocyanate
urea-siloxane polymer, composed of amino-terminated polydimethylsiloxane oligomer, hexamethylene diisocyanate and 2,2(4),4-trimethyl-1,6-diaminohexane, ratio siloxane diamine/diaminohexane 4:1, molecular weight 23790 g/mol
Conditions | Yield |
---|---|
In tetrahydrofuran at 20℃; for 2h; |
2,2,4-trimethylhexamethylenediamine
2,4,4-trimethylhexamethylenediamine
Hexamethylene diisocyanate
urea-siloxane polymer, composed of amino-terminated polydimethylsiloxane oligomer, hexamethylene diisocyanate and 2,2(4),4-trimethyl-1,6-diaminohexane, ratio siloxane diamine/diaminohexane 3:1, molecular weight 16000 g/mol
Conditions | Yield |
---|---|
In tetrahydrofuran at 20℃; for 2h; |
Conditions | Yield |
---|---|
Stage #1: 2,4,4-trimethylhexamethylenediamine; 3-glycidoxypropyltrimethoxysilane In ethanol at 70℃; for 3h; Stage #2: With acetic acid In ethanol |
Conditions | Yield |
---|---|
Stage #1: 2,4,4-trimethylhexamethylenediamine; 3-glycidoxypropyltrimethoxysilane In ethanol at 70℃; for 3h; Stage #2: With acetic acid In ethanol |
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The 1,6-Hexanediamine,2,4,4-trimethyl-, with the CAS registry number 3236-54-2 and EINECS registry number 221-793-1, has the systematic name of 2,4,4-trimethylhexane-1,6-diamine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C9H22N2.
The characteristics of 1,6-Hexanediamine,2,4,4-trimethyl- are as followings: (1)ACD/LogP: 1.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.01; (4)ACD/LogD (pH 7.4): -3.01; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.461; (14)Molar Refractivity: 50.73 cm3; (15)Molar Volume: 184.8 cm3; (16)Polarizability: 20.11×10-24cm3; (17)Surface Tension: 32.3 dyne/cm; (18)Density: 0.856 g/cm3; (19)Flash Point: 102.4 °C; (20)Enthalpy of Vaporization: 46.06 kJ/mol; (21)Boiling Point: 224.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0929 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: NCCC(CC(C)CN)(C)C
(2)InChI: InChI=1/C9H22N2/c1-8(7-11)6-9(2,3)4-5-10/h8H,4-7,10-11H2,1-3H3
(3)InChIKey: DPQHRXRAZHNGRU-UHFFFAOYAZ