3,4-Pyridinediamine,6-methyl- supplier

Name
6-METHYL-3,4-PYRIDINEDIAMINE
EINECS
CAS No. 861199-62-4
Density 1.19 g/cm³
Solubility
Melting Point
Formula C₆H₉N₃
Boiling Point 341.5 °C at 760 mmHg
Molecular Weight 123.158
Flash Point 187 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Methyl-3,4-pyridinediamine;3,4-Diamino-6-methylpyridine;
PSA 64.93000
LogP 1.71680

3,4-Pyridinediamine,6-methyl- Specification

The IUPAC name of 3,4-Pyridinediamine,6-methyl- is 6-methylpyridine-2,3-diamine. With the CAS registry number 861199-62-4, it is also named as 3,4-Diamino-6-methylpyridine. In addition, its molecular formula is C₆H₉N₃ and its molecular weight is 123.15576.

The other characteristics of 3,4-Pyridinediamine,6-methyl- can be summarized as: (1)ACD/LogP: 0.37; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1.99; (7)#H bond acceptors: 3; (8)#H bond donors: 4; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 64.93 Å²; (11)Index of Refraction: 1.647; (12)Molar Refractivity: 37.64 cm³; (13)Molar Volume: 103.4 cm³; (14)Polarizability: 14.92×10^-24cm³; (15)Surface Tension: 62.2 dyne/cm; (16)Density: 1.19 g/cm³; (17)Flash Point: 187 °C; (18)Enthalpy of Vaporization: 58.51 kJ/mol; (19)Boiling Point: 341.5 °C at 760 mmHg; (20)Vapour Pressure: 8.03E-05 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: Nc1cnc(C)cc1N
(2)InChI: InChI=1/C6H9N3/c1-4-2-5(7)6(8)3-9-4/h2-3H,8H2,1H3,(H2,7,9)
(3)InChIKey: OGCOZWIGCBYCDQ-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C6H9N3/c1-4-2-5(7)6(8)3-9-4/h2-3H,8H2,1H3,(H2,7,9)
(5)Std. InChIKey: OGCOZWIGCBYCDQ-UHFFFAOYSA-N

Product Name

6-METHYL-3,4-PYRIDINEDIAMINE

3,4-Pyridinediamine,6-methyl- Specification

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