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2-N-Methyl-2-pyridylaminoethanol

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Name

2-N-Methyl-2-pyridylaminoethanol

EINECS 602-493-3
CAS No. 122321-04-4 Density 1.13 g/cm3
PSA 36.36000 LogP 0.51010
Solubility Soluble in water. Melting Point N/A
Formula C8H12N2O Boiling Point 281.2 °C at 760 mmHg
Molecular Weight 152.196 Flash Point 123.9 °C
Transport Information N/A Appearance clear light yellow to light brown viscous liquid
Safety 37/39-26 Risk Codes 36/37/38-22
Molecular Structure Molecular Structure of 122321-04-4 (2-N-Methyl-2-pyridylaminoethanol) Hazard Symbols HarmfulXn
Synonyms

2-(Methyl-2-pyridylamino)ethanol;2-[Methyl(2-pyridinyl)amino]ethanol;2-[N-Methyl-N-(2-pyridyl)amino]ethanol;

Article Data 23

2-N-Methyl-2-pyridylaminoethanol Specification

The IUPAC name of Ethanol,2-(methyl-2-pyridinylamino)- is 2-[methyl(pyridin-1-ium-2-yl)amino]ethanol. With the CAS registry number 122321-04-4, it is also named as 2-(N-Methyl-2-pyridylamino)ethanol. It is clear light yellow to light brown viscous liquid which is used as intermediate of drug Rosiglitazone. Additioanlly, this chemical should be sealed in the container and stored in the cool and dry place.

The other characteristics of Ethanol,2-(methyl-2-pyridinylamino)- can be summarized as: (1)ACD/LogP: 0.65; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 25.36 Å2; (7)Index of Refraction: 1.58; (8)Molar Refractivity: 44.82 cm3; (9)Molar Volume: 134.6 cm3; (10)Polarizability: 17.77×10-24 cm3; (11)Surface Tension: 51 dyne/cm; (12)Flash Point: 123.9 °C; (13)Enthalpy of Vaporization: 54.92 kJ/mol; (14)Boiling Point: 281.2 °C at 760 mmHg; (15)Vapour Pressure: 0.00172 mmHg at 25°C; (16)Rotatable Bond Count: 3; (17)Exact Mass: 153.102788; (18)MonoIsotopic Mass: 153.102788; (19)Topological Polar Surface Area: 37.6; (20)Heavy Atom Count: 11; (21)Formal Charge: 1; (22)Complexity: 108.

When you are using this chemical, please be cautious about it as the following:
It is not only harmful if swallowed, but also irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
1. SMILES:OCCN(c1ncccc1)C
2. InChI:InChI=1/C8H12N2O/c1-10(6-7-11)8-4-2-3-5-9-8/h2-5,11H,6-7H2,1H3
3. InChIKey:MWGKOPUDDQZERY-UHFFFAOYAQ

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