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| CAS No.: | 7396-58-9 |
|---|---|
| Name: | N-Methyldidecylamine |
| Molecular Structure: | |
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| Formula: | C21H45N |
| Molecular Weight: | 311.595 |
| Synonyms: | Didecylamine,N-methyl- (6CI,7CI,8CI);Armeen M 210D;DAMA 1010;Didecylmethylamine;Methyldidecylamine;N,N-Didecyl-N-methylamine;N-Methyldidecylamine;Radiamine6310; |
| EINECS: | 230-990-1 |
| Density: | 0.814 g/cm3 |
| Melting Point: | -7.4 °C |
| Boiling Point: | 365.2 °C at 760 mmHg |
| Flash Point: | 165.1 °C |
| Solubility: | Insoluble in water and less dense than water |
| Appearance: | clear slightly light yellow liquid with a fishlike odor |
| Transport Information: | UN 2735 8/PG 3 |
| PSA: | 3.24000 |
| LogP: | 7.19960 |
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Specification
The CAS register number of N-Methyldidecylamine is 7396-58-9. It also can be called as Didecylmethylamine and the IUPAC name about this chemical is N-decyl-N-methyldecan-1-amine. The molecular formula about this chemical is C21H45N and molecular weight is 311.59.
Physical properties about N-Methyldidecylamine are: (1)ACD/LogP: 9.63; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.55; (4)ACD/LogD (pH 7.4): 7.28; (5)ACD/BCF (pH 5.5): 10261.66; (6)ACD/BCF (pH 7.4): 54508.23; (7)ACD/KOC (pH 5.5): 3457.58; (8)ACD/KOC (pH 7.4): 18366.09; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 18; (11)Polar Surface Area: 3.24Å2; (12)Index of Refraction: 1.451; (13)Molar Refractivity: 103.06 cm3; (14)Molar Volume: 382.4 cm3; (15)Polarizability: 40.85x10-24cm3; (16)Surface Tension: 29.7 dyne/cm; (17)Enthalpy of Vaporization: 61.15 kJ/mol; (18)Boiling Point: 365.2 °C at 760 mmHg; (19)Vapour Pressure: 1.6E-05 mmHg at 25°C.
Uses of N-Methyldidecylamine: it can be used to produce C45H96N2O(2+)*2Cl(1-) with chloromethyl-oxirane and bis-decyl-methyl-amine; hydrochloride at heating. This reaction will need solvent propan-1-ol with reaction time of 24 hours. The yield is about 82%.
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You can still convert the following datas into molecular structure:
(1)SMILES: N(CCCCCCCCCC)(C)CCCCCCCCCC
(2)InChI: InChI=1/C21H45N/c1-4-6-8-10-12-14-16-18-20-22(3)21-19-17-15-13-11-9-7-5-2/h4-21H2,1-3H3
(3)InChIKey: ATBNMWWDBWBAHM-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C21H45N/c1-4-6-8-10-12-14-16-18-20-22(3)21-19-17-15-13-11-9-7-5-2/h4-21H2,1-3H3
(5)Std. InChIKey: ATBNMWWDBWBAHM-UHFFFAOYSA-N