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4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine

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Name

4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine

EINECS 401-360-5
CAS No. 5248-39-5 Density 1.196 g/cm3
PSA 59.93000 LogP 0.30330
Solubility N/A Melting Point 162-166 °C(lit.)
Formula C6H10N4O Boiling Point 304.9 °C at 760 mmHg
Molecular Weight 154.172 Flash Point 138.2 °C
Transport Information N/A Appearance N/A
Safety 26-36-22-2 Risk Codes 22-36/37/38-48-48/22
Molecular Structure Molecular Structure of 5248-39-5 (4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine) Hazard Symbols HarmfulXn
Synonyms

s-Triazine,2-methoxy-4-methyl-6-(methylamino)- (7CI,8CI);2-Methyl-4-(methylamino)-6-methoxy-1,3,5-triazine;2-Amino-4-methyl-6-methoxy(N-methyl)-1,3,5-triazine;

Article Data 10

4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine Specification

The 4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine, with the CAS registry number 5248-39-5 and EINECS registry number 401-360-5, has the systematic name of 4-methoxy-N,6-dimethyl-1,3,5-triazin-2-amine. It belongs to the following product categories: Building Blocks; Heterocyclic Building Blocks; Triazines. And the molecular formula of this chemical is C6H10N4O.

The physical properties of 4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine are as following: (1)ACD/LogP: -0.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.76; (4)ACD/LogD (pH 7.4): -0.75; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 9.15; (8)ACD/KOC (pH 7.4): 9.27; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 51.14 Å2; (13)Index of Refraction: 1.559; (14)Molar Refractivity: 41.63 cm3; (15)Molar Volume: 128.8 cm3; (16)Polarizability: 16.5×10-24cm3; (17)Surface Tension: 50.1 dyne/cm; (18)Density: 1.196 g/cm3; (19)Flash Point: 138.2 °C; (20)Enthalpy of Vaporization: 54.54 kJ/mol; (21)Boiling Point: 304.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000847 mmHg at 25°C.

Preparation and use of 4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine: It can be prepared by cyanuric chloride, magnesium bromide methane, methylamine and methanol. And it is used to produce tribenuron-methyl.

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin, and it is also harmful if swallowed. In addition, it has danger of serious damage to health by prolonged exposure if swallowed. Therefore, you had better take the following instructions: Wear suitable protective clothing, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice; Keep out of the reach of children; Do not breathe dust.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1nc(nc(n1)NC)C)C
(2)InChI: InChI=1/C6H10N4O/c1-4-8-5(7-2)10-6(9-4)11-3/h1-3H3,(H,7,8,9,10)
(3)InChIKey: MNDSUSQBIDHEJU-UHFFFAOYAJ

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 400mg/kg (400mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 95, Pg. 512, 1975.
rat LD50 oral 394mg/kg (394mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION
National Technical Information Service. Vol. OTS0570716,

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