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1H-Imidazole-1-methanol

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Name

1H-Imidazole-1-methanol

EINECS N/A
CAS No. 51505-76-1 Density 1.21 g/cm3
PSA 38.05000 LogP -0.16710
Solubility N/A Melting Point 134℃
Formula C4H6N2O Boiling Point 307.7 °C at 760 mmHg
Molecular Weight 98.1044 Flash Point 139.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 51505-76-1 (1H-IMIDAZOL-1-YLMETHANOL) Hazard Symbols N/A
Synonyms

1-Hydroxymethylimidazole;N-Hydroxymethylimidazole;

Article Data 9

1H-Imidazole-1-methanol Specification

The CAS register number of 1H-Imidazole-1-methanol is 51505-76-1. It also can be called as 1-Hydroxymethylimidazole and the IUPAC name about this chemical is imidazol-1-ylmethanol. The molecular formula about this chemical is C4H6N2O and the molecular weight is 98.1032. It belongs to the following product categories which include Imidazol & Benzimidazole and so on.

Physical properties about 1H-Imidazole-1-methanol are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 4.08; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 27.05 Å2; (9)Index of Refraction: 1.564; (10)Molar Refractivity: 26.28 cm3; (11)Molar Volume: 80.7 cm3; (12)Polarizability: 10.42x10-24cm3; (13)Surface Tension: 49 dyne/cm; (14)Density: 1.21 g/cm3; (15)Flash Point: 139.9 °C; (16)Enthalpy of Vaporization: 57.89 kJ/mol; (17)Boiling Point: 307.7 °C at 760 mmHg; (18)Vapour Pressure: 0.00031 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: OCn1ccnc1
(2)InChI: InChI=1/C4H6N2O/c7-4-6-2-1-5-3-6/h1-3,7H,4H2
(3)InChIKey: XPPVBKJELBDMMR-UHFFFAOYAP

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