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5-Ethyl-2-pyrimidinamine

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Name

5-Ethyl-2-pyrimidinamine

EINECS N/A
CAS No. 39268-71-8 Density 1.11 g/cm3
PSA 51.80000 LogP 1.20240
Solubility N/A Melting Point N/A
Formula C6H9N3 Boiling Point 286.7 °C at 760 mmHg
Molecular Weight 123.158 Flash Point 152 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 39268-71-8 (5-ETHYL-2-PYRIMIDINAMINE) Hazard Symbols N/A
Synonyms

Pyrimidine,2-amino-5-ethyl- (6CI,7CI);

 

5-Ethyl-2-pyrimidinamine Specification

The 2-Pyrimidinamine,5-ethyl- is an organic compound with the formula C6H9N3. The systematic name of this chemical is 5-ethylpyrimidin-2-amine. With the CAS registry number 39268-71-8, it is also named as 2-Amino-5-ethylpyrimidine. The product's category is Pyrimidine.

Physical properties about 2-Pyrimidinamine,5-ethyl- are: (1)ACD/LogP: 0.77; (2)ACD/LogD (pH 5.5): 0.75; (3)ACD/LogD (pH 7.4): 0.77; (4)ACD/BCF (pH 5.5): 2.14; (5)ACD/BCF (pH 7.4): 2.27; (6)ACD/KOC (pH 5.5): 59.12; (7)ACD/KOC (pH 7.4): 62.57; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 51.8 Å2; (12)Index of Refraction: 1.566; (13)Molar Refractivity: 36.22 cm3; (14)Molar Volume: 110.9 cm3; (15)Polarizability: 14.35×10-24cm3; (16)Surface Tension: 51.9 dyne/cm; (17)Density: 1.109 g/cm3; (18)Flash Point: 152 °C; (19)Enthalpy of Vaporization: 52.58 kJ/mol; (20)Boiling Point: 286.7 °C at 760 mmHg; (21)Vapour Pressure: 0.0026 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCc1cnc(N)nc1
(2)InChI: InChI=1/C6H9N3/c1-2-5-3-8-6(7)9-4-5/h3-4H,2H2,1H3,(H2,7,8,9)
(3)InChIKey: YCHYGGNTIXJETG-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C6H9N3/c1-2-5-3-8-6(7)9-4-5/h3-4H,2H2,1H3,(H2,7,8,9)
(5)Std. InChIKey: YCHYGGNTIXJETG-UHFFFAOYSA-N

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