2-Pyrimidinamine,4-(1,1-dimethylethyl)-6-(trifluoromethyl)- supplier

Name
2-AMINO-6-T-BUTYL-4-(TRIFLUOROMETHYL)PYRIMIDINE
EINECS
CAS No. 238742-83-1
Density 1.229 g/cm³
Solubility
Melting Point 48 °C
Formula C₉H₁₂F₃N₃
Boiling Point 271.4 °C at 760 mmHg
Molecular Weight 219.21
Flash Point 117.9 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 4-(TERT-BUTYL)-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-AMINE;4-TERT-BUTYL-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YLAMINE;4-(T-BUTYL)-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-AMINE;AKOS BBS-00000211;2-AMINO-6-(TERT-BUTYL)-4-(TRIFLUOROMETHYL)PYRIMIDINE;2-AMINO-6-T-BUTYL-4-(TRIFLUOROMETHYL)PYRIMIDINE;2-AMINO-4-T-BUTYL-6-(TRIFLUOROMETHYL)PYRIMIDINE;2-AMINO-4-TERT-BUTYL-6-(TRIFLUOROMETHYL)PYRIMIDINE
PSA 51.80000
LogP 2.95630

2-Pyrimidinamine,4-(1,1-dimethylethyl)-6-(trifluoromethyl)- Specification

The 2-Pyrimidinamine,4-(1,1-dimethylethyl)-6-(trifluoromethyl)- is an organic compound with the formula C₉H₁₂F₃N₃. The IUPAC name of this chemical is 4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-amine. With the CAS registry number 238742-83-1, it is also named as 2-Amino-4-t-butyl-6-(trifluoromethyl)pyrimidine. The product's categories are Pyrimidine Series; Amines; Pyrazines, Pyrimidines & Pyridazines.

Physical properties about 2-Pyrimidinamine,4-(1,1-dimethylethyl)-6-(trifluoromethyl)- are: (1)ACD/LogP: 2.04; (2)ACD/LogD (pH 5.5): 2.44; (3)ACD/LogD (pH 7.4): 2.44; (4)ACD/BCF (pH 5.5): 42.11; (5)ACD/BCF (pH 7.4): 42.11; (6)ACD/KOC (pH 5.5): 506.23; (7)ACD/KOC (pH 7.4): 506.27; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 29.02 Å²; (12)Index of Refraction: 1.473; (13)Molar Refractivity: 50.03 cm³; (14)Molar Volume: 178.3 cm³; (15)Polarizability: 19.83×10^-24cm³; (16)Surface Tension: 32.7 dyne/cm; (17)Density: 1.229 g/cm³; (18)Flash Point: 117.9 °C; (19)Enthalpy of Vaporization: 50.96 kJ/mol; (20)Boiling Point: 271.4 °C at 760 mmHg; (21)Vapour Pressure: 0.00647 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1nc(nc(c1)C(C)(C)C)N
(2)InChI: InChI=1/C9H12F3N3/c1-8(2,3)5-4-6(9(10,11)12)15-7(13)14-5/h4H,1-3H3,(H2,13,14,15)
(3)InChIKey: XIUFUZWOHSSRKX-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C9H12F3N3/c1-8(2,3)5-4-6(9(10,11)12)15-7(13)14-5/h4H,1-3H3,(H2,13,14,15)
(5)Std. InChIKey: XIUFUZWOHSSRKX-UHFFFAOYSA-N

Product Name

2-AMINO-6-T-BUTYL-4-(TRIFLUOROMETHYL)PYRIMIDINE

2-Pyrimidinamine,4-(1,1-dimethylethyl)-6-(trifluoromethyl)- Specification

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