Methyl 2-amino-6-methylisonicotinate supplier

Name
2-AMino-6-MethylisonicotinicacidMethylester
EINECS
CAS No. 1029128-50-4
Article Data4
CAS DataBase
Density 1.195 g/cm³
Solubility
Melting Point
Formula C₈H₁₀N₂O₂
Boiling Point 303.103 °C at 760 mmHg
Molecular Weight 166.18
Flash Point 137.112 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-6-methylisonicotinic acid methyl ester;
PSA 65.94000
LogP 0.68890

Methyl 2-amino-6-methylisonicotinate Specification

The Methyl 2-amino-6-methylisonicotinate, with the CAS registry number 1029128-50-4, is also known as 2-Amino-6-methylisonicotinic acid methyl ester. This chemical's molecular formula is C₈H₁₀N₂O₂ and molecular weight is 166.18. What's more, its systematic name is Methyl 2-amino-6-methylisonicotinate.

Physical properties of Methyl 2-amino-6-methylisonicotinate are: (1)ACD/LogP: 1.334; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.18; (4)ACD/LogD (pH 7.4): 1.33; (5)ACD/BCF (pH 5.5): 4.28; (6)ACD/BCF (pH 7.4): 6.05; (7)ACD/KOC (pH 5.5): 89.17; (8)ACD/KOC (pH 7.4): 126.07; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 65.21 Å²; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 45.178 cm³; (15)Molar Volume: 139.105 cm³; (16)Polarizability: 17.91×10^-24cm³; (17)Surface Tension: 49.9 dyne/cm; (18)Density: 1.195 g/cm³; (19)Flash Point: 137.112 °C; (20)Enthalpy of Vaporization: 54.337 kJ/mol; (21)Boiling Point: 303.103 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(cc(n1)N)C(=O)OC
(2)Std. InChI: InChI=1S/C8H10N2O2/c1-5-3-6(8(11)12-2)4-7(9)10-5/h3-4H,1-2H3,(H2,9,10)
(3)Std. InChIKey: XXFVJWCKNWSTCY-UHFFFAOYSA-N

Product Name

2-AMino-6-MethylisonicotinicacidMethylester

Methyl 2-amino-6-methylisonicotinate Specification

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