5-Aminomethyl-1H-pyridin-2-one supplier

Name
5-Aminomethyl-1H-pyridin-2-one
EINECS
CAS No. 131052-84-1
Density 1.228g/cm³
Solubility
Melting Point
Formula C₆H₈N₂O
Boiling Point 365.7 °C at 760 mmHg
Molecular Weight 124.142
Flash Point 175 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-aminomethyl-pyridin-2-ol;5-(aminomethyl)pyridin-2(1H)-one;5-aminomethyl-1H-pyridine-2-one;5-Aminomethyl-1H-pyridin-2-one;
PSA 58.88000
LogP 0.53390

5-Aminomethyl-1H-pyridin-2-one Specification

The 5-Aminomethyl-1H-pyridin-2-one, with CAS registry number 131052-84-1, belongs to the following product category: Pyridine. It has the systematic name of 5-(aminomethyl)pyridin-2-ol. Besides this, it is also called 2(1H)-Pyridinone,5-(aminomethyl)-(9CI). And the chemical formula of this chemical is C₆H₈N₂O.

Physical properties of 5-Aminomethyl-1H-pyridin-2-one: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 59.14 Å²; (10)Index of Refraction: 1.602; (11)Molar Refractivity: 34.67 cm³; (12)Molar Volume: 101 cm³; (13)Polarizability: 13.74×10^-24cm³; (14)Surface Tension: 60.8 dyne/cm; (15)Density: 1.228 g/cm³; (16)Flash Point: 175 °C; (17)Enthalpy of Vaporization: 63.61 kJ/mol; (18)Boiling Point: 365.7 °C at 760 mmHg; (19)Vapour Pressure: 7.32E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: NCc1cnc(O)cc1
(2)InChI: InChI=1/C6H8N2O/c7-3-5-1-2-6(9)8-4-5/h1-2,4H,3,7H2,(H,8,9)
(3)InChIKey: CSVYITCBZGOVBG-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C6H8N2O/c7-3-5-1-2-6(9)8-4-5/h1-2,4H,3,7H2,(H,8,9)
(5)Std. InChIKey: CSVYITCBZGOVBG-UHFFFAOYSA-N

Product Name

5-Aminomethyl-1H-pyridin-2-one

5-Aminomethyl-1H-pyridin-2-one Specification

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