1H-Imidazole-2-methanamine,1-methyl- supplier

Name
2-(AMINOMETHYL)-1-METHYLIMIDAZOLE
EINECS
CAS No. 124312-73-8
Article Data6
CAS DataBase
Density 1.16 g/cm³
Solubility
Melting Point
Formula C₅H₉N₃
Boiling Point 255.1 °C at 760 mmHg
Molecular Weight 111.147
Flash Point 108.1 °C
Transport Information
Appearance
Safety
Risk Codes C:Corrosive;
Molecular Structure
Hazard Symbols R34:Causes burns.;
Synonyms (1-Methyl-1H-imidazol-2-yl)methanamine;1-Methyl-2-aminomethylimidazo;2-Aminomethyl-1-methylimidazole;C-(1-Methyl-1H-imidazol-2-yl)methylamine;[(1-Methyl-1H-imidazol-2-yl)methyl]amine;
PSA 29.85000
LogP 0.53480

1H-Imidazole-2-methanamine,1-methyl- Specification

The 1H-Imidazole-2-methanamine,1-methyl-, with the CAS registry number 124312-73-8, is also known as (1-Methyl-1H-imidazol-2-yl)methanamine. This chemical's molecular formula is C₅H₉N₃ and molecular weight is 111.1451. What's more, its systematic name is called 1-(1-Methyl-1H-imidazol-2-yl)methanamine.

Physical properties about 1H-Imidazole-2-methanamine,1-methyl- are: (1)ACD/LogP: -0.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.67; (4)ACD/LogD (pH 7.4): -2.1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 21.06 Å²; (13)Index of Refraction: 1.579; (14)Molar Refractivity: 31.77 cm³; (15)Molar Volume: 95.5 cm³; (16)Surface Tension: 44 dyne/cm; (17)Density: 1.16 g/cm³; (18)Flash Point: 108.1 °C; (19)Enthalpy of Vaporization: 49.26 kJ/mol; (20)Boiling Point: 255.1 °C at 760 mmHg; (21)Vapour Pressure: 0.0166 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: n1ccn(c1CN)C
(2) InChI: InChI=1/C5H9N3/c1-8-3-2-7-5(8)4-6/h2-3H,4,6H2,1H3
(3) InChIKey: PZSMLGOAJXSDMK-UHFFFAOYAT

Product Name

2-(AMINOMETHYL)-1-METHYLIMIDAZOLE

1H-Imidazole-2-methanamine,1-methyl- Specification

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