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N-Methylallylamine

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Name

N-Methylallylamine

EINECS 210-996-0
CAS No. 627-37-2 Density 0.741 g/cm3
PSA N/A LogP N/A
Solubility Very soluble in water Melting Point 76ºC
Formula C4H9N Boiling Point 65 °C at 760 mmHg
Molecular Weight 71.1222 Flash Point -19 °F
Transport Information UN 3286 Appearance colourless liquid,
Safety 26-36/37/39-45 Risk Codes 11-23/24/25-34
Molecular Structure Molecular Structure of 627-37-2 (N-Allylmethylamine) Hazard Symbols ToxicT,FlammableF
Synonyms

Allylamine, N-methyl- (7CI,8CI);Allylmethylamine;Methylallylamine;N-Allyl-N-methylamine;N-Allylmethylamine;N-Methyl-2-propen-1-amine;N-Methyl-N-allylamine;N-Methylallylamine;N-Methylprop-2-enamine;

Article Data 24

N-Methylallylamine Specification

The N-Methylallylamine, with CAS registry number 627-37-2, has the systematic name of N-methylprop-2-en-1-amine. And its IUPAC name is the same one. This chemical is a kind of colorless to light yellow liquid. And this chemical should be stored at the temperature of 2-8°C. What's more, its EINECS is 210-996-0.

Physical properties of N-Methylallylamine: (1)ACD/LogP: 0.27; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 12.03 Å2; (7)Index of Refraction: 1.4; (8)Molar Refractivity: 23.9 cm3; (9)Molar Volume: 98.4 cm3; (10)Polarizability: 9.47×10-24cm3; (11)Surface Tension: 20 dyne/cm; (12)Enthalpy of Vaporization: 30.7 kJ/mol; (13)Vapour Pressure: 161 mmHg at 25°C. 

Uses of p-Chloropropiophenone: it can be used to produce N-allyl-a,a-dichloro-N-methylacetamide. The yield of this reaction is about 95%.

p-Chloropropiophenone can be used to produce N-allyl-a,a-dichloro-N-methylacetamide

The N-Methylallylamine is highly flammable, so it may cause burns. And this chemical is toxic by inhalation, in contact with skin and if swallowed. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: C=CCNC
(2)InChI: InChI=1/C4H9N/c1-3-4-5-2/h3,5H,1,4H2,2H3
(3)InChIKey: IOXXVNYDGIXMIP-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C4H9N/c1-3-4-5-2/h3,5H,1,4H2,2H3
(5)Std. InChIKey: IOXXVNYDGIXMIP-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 500uL/kg (0.5mL/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ATAXIA

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
National Technical Information Service. Vol. OTS0544970

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