CAS No.1126-71-2,N,N-DIMETHYL-N-PHENETHYLAMINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1126-71-2
Name:	N,N-DIMETHYL-N-PHENETHYLAMINE
Article Data:	115

Formula:	C₁₀H₁₅N
Molecular Weight:	149.236
Synonyms:	Phenethylamine,N,N-dimethyl- (8CI);Dimethyl(2-phenylethyl)amine;Dimethylphenethylamine;N,N-Dimethyl-2-phenylethylamine;N,N-Dimethyl-b-phenethylamine;N,N-Dimethylbenzeneethanamine;N,N-Dimethylphenethylamine;N,N-Dimethylphenylethylamine;N-(2-Phenylethyl)dimethylamine;N-Phenethyldimethylamine;NSC 1849;[(Dimethylamino)ethyl]benzene;
Density:	0.918 g/cm³
Melting Point:	143°C (estimate)
Boiling Point:	207.3 °C at 760 mmHg
Flash Point:	71.4 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	3.24000
LogP:	1.79070

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Specification

The CAS register number of Benzeneethanamine,N,N-dimethyl- is 1126-71-2. It also can be called as Dimethylphenethylamine and the IUPAC name about this chemical is N,N-dimethyl-2-phenylethanamine. The molecular formula about this chemical is C₁₀H₁₅N and the molecular weight is 149.23. It belongs to the following product categories which include Amines; C₉ to C₁₀; Nitrogen Compounds and so on.

Physical properties about Benzeneethanamine,N,N-dimethyl- are: (1)ACD/LogP: 2.14; (2)ACD/LogD (pH 5.5): -0.93; (3)ACD/LogD (pH 7.4): -0.14; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1.81; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 3.24 Å²; (11)Index of Refraction: 1.512; (12)Molar Refractivity: 48.78 cm³; (13)Molar Volume: 162.5 cm³; (14)Polarizability: 19.34x10^-24cm³; (15)Surface Tension: 32.8 dyne/cm; (16)Density: 0.918 g/cm³; (17)Flash Point: 71.4 °C; (18)Enthalpy of Vaporization: 44.36 kJ/mol; (19)Boiling Point: 207.3 °C at 760 mmHg; (20)Vapour Pressure: 0.227 mmHg at 25 °C.

Preparation: this chemical can be prepared by N,N-dimethyl-phenylalanine nitrile. This reaction will need reagents of Na, liq. NH₃ and solvent of tetrahydrofuran. The reaction time is 30 minutes with reaction temperature of -78 °C. The yield is about 95%.

Benzeneethanamine,N,N-dimethyl- can be prepared by N,N-dimethyl-phenylalanine nitrile.

Uses of Benzeneethanamine,N,N-dimethyl-: it can be used to produce N-Nitroso-N-methyl-b-phenethylamine. This reaction will need reagents of dinitrogen tetraoxide excess, conc. hydrochloric acid and solvent of acetic anhydride. The reaction time is 14 hours with reaction temperature of 25 °C. The yield is about 84%.

Benzeneethanamine,N,N-dimethyl- can be used to produce N-Nitroso-N-methyl-b-phenethylamine.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin and it may cause inflammation to the skin or other mucous membranes. If you want to use it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Usually it is not harmful to water, if no official permission, do not put materials into the permission surroundings. It is stable under normal temperature and pressure and if you want to store it, you should keep the container tightly sealed in dry, cool places.

You can still convert the following datas into molecular structure:
(1)SMILES: N(CCc1ccccc1)(C)C
(2)InChI: InChI=1/C10H15N/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
(3)InChIKey: TXOFSCODFRHERQ-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C10H15N/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
(5)Std. InChIKey: TXOFSCODFRHERQ-UHFFFAOYSA-N

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