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2(1H)-Pyridinone,4-(hydroxymethyl)-

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Name

2(1H)-Pyridinone,4-(hydroxymethyl)-

EINECS N/A
CAS No. 127838-58-8 Density 1.225 g/cm3
PSA 53.09000 LogP -0.13280
Solubility N/A Melting Point N/A
Formula C6H7NO2 Boiling Point 428.035 °C at 760 mmHg
Molecular Weight 125.127 Flash Point 212.668 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 127838-58-8 (2(1H)-Pyridinone,4-(hydroxymethyl)-(9CI)) Hazard Symbols N/A
Synonyms

4-(Hydroxymethyl)-2(1H)-pyridinone;

Article Data 8

2(1H)-Pyridinone,4-(hydroxymethyl)- Specification

This chemical is called 2(1H)-Pyridinone,4-(hydroxymethyl)-, and its systematic name is 4-(hydroxymethyl)pyridin-2-ol. With the molecular formula of C6H7NO2, its molecular weight is 125.1253. The CAS registry number of this chemical is 127838-58-8. Additionally, its product category is Pyridine.

Other characteristics of the 2(1H)-Pyridinone,4-(hydroxymethyl)- can be summarised as followings: (1)ACD/LogP: -1.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1; (4)ACD/LogD (pH 7.4): -1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 6; (8)ACD/KOC (pH 7.4): 6; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 49.33 Å2; (13)Index of Refraction: 1.538; (14)Molar Refractivity: 31.969 cm3; (15)Molar Volume: 102.135 cm3; (16)Polarizability: 12.674×10-24cm3; (17)Surface Tension: 43.703 dyne/cm; (18)Density: 1.225 g/cm3; (19)Flash Point: 212.668 °C; (20)Enthalpy of Vaporization: 78.879 kJ/mol; (21)Boiling Point: 428.035 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: OCc1ccnc(O)c1
2.InChI: InChI=1/C6H7NO2/c8-4-5-1-2-7-6(9)3-5/h1-3,8H,4H2,(H,7,9)
3.InChIKey: NVWMXLBVGGYAQW-UHFFFAOYAN

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