2,3-Pyridinediamine,N2-methyl-5-(trifluoromethyl)- supplier

Name
3-AMINO-2-(METHYLAMINO)-5-(TRIFLUOROMETHYL)PYRIDINE
EINECS
CAS No. 172648-55-4
Article Data1
CAS DataBase
Density 1.386g/cm³
Solubility
Melting Point 99-101°C
Formula C₇H₈F₃N₃
Boiling Point 285.5 °C at 760 mmHg
Molecular Weight 191.156
Flash Point 126.5 °C
Transport Information
Appearance
Safety 24/25-36/37/39
Risk Codes 20/21/22-36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms N2-METHYL-5-TRIFLUOROMETHYL-PYRIDINE-2,3-DIAMINE;3-AMINO-2-(METHYLAMINO)-5-(TRIFLUOROMETHYL)PYRIDINE;BUTTPARK 145\15-11;3-Amino-2-(methylamino)-5-(trifluoromethyl)pyridine 97%;3-Amino-2-(methylamino)-5-(trifluoromethyl)pyridine97%;5-(trifluoroMethyl)-N2-Methylpyridine-2,3-diaMine;5-(trifluoroMethyl)-N2-Methylpyridine-2;3-Amino-2-(methylamino)-5-(trifluoromethyl)pyridine, 5-Amino-6-(methylamino)-alpha,alpha,alpha-trifluoro-3-picoline
PSA 50.94000
LogP 2.37850

2,3-Pyridinediamine,N2-methyl-5-(trifluoromethyl)- Specification

The 2,3-Pyridinediamine,N2-methyl-5-(trifluoromethyl)-, with CAS registry number 172648-55-4, belongs to the following product categories: (1)Amines; (2)Pyridines. It has the systematic name of N~2~-methyl-5-(trifluoromethyl)pyridine-2,3-diamine. And the chemical formula of this chemical is C₇H₈F₃N₃.

Physical properties of 2,3-Pyridinediamine,N2-methyl-5-(trifluoromethyl)-: (1)ACD/LogP: 2.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.39; (4)ACD/LogD (pH 7.4): 2.54; (5)ACD/BCF (pH 5.5): 35.39; (6)ACD/BCF (pH 7.4): 50.5; (7)ACD/KOC (pH 5.5): 403.41; (8)ACD/KOC (pH 7.4): 575.65; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 19.37 Å²; (13)Index of Refraction: 1.538; (14)Molar Refractivity: 43.16 cm³; (15)Molar Volume: 137.9 cm³; (16)Polarizability: 17.11×10^-24cm³; (17)Surface Tension: 38.4 dyne/cm; (18)Density: 1.386 g/cm³; (19)Flash Point: 126.5 °C; (20)Enthalpy of Vaporization: 52.45 kJ/mol; (21)Boiling Point: 285.5 °C at 760 mmHg; (22)Vapour Pressure: 0.0028 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 2,3-Pyridinediamine,N2-methyl-5-(trifluoromethyl)- irritates to eyes, respiratory system and skin. And this chemical is harmful by inhalation, in contact with skin and if swallowed. You should avoid contact with skin and eyes. When use it, wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cnc(NC)c(N)c1
(2)InChI: InChI=1/C7H8F3N3/c1-12-6-5(11)2-4(3-13-6)7(8,9)10/h2-3H,11H2,1H3,(H,12,13)
(3)InChIKey: RLRUNZFXEAZVIT-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C7H8F3N3/c1-12-6-5(11)2-4(3-13-6)7(8,9)10/h2-3H,11H2,1H3,(H,12,13)
(5)Std. InChIKey: RLRUNZFXEAZVIT-UHFFFAOYSA-N

Product Name

3-AMINO-2-(METHYLAMINO)-5-(TRIFLUOROMETHYL)PYRIDINE

2,3-Pyridinediamine,N2-methyl-5-(trifluoromethyl)- Specification

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