2-Methyl-1H-imidazole-1-propanamine supplier

Name
3-(2-METHYL-1H-IMIDAZOL-1-YL)PROPYLAMINE
EINECS
CAS No. 2258-21-1
Article Data8
CAS DataBase
Density 1.08 g/cm³
Solubility
Melting Point
Formula C₇H₁₃N₃
Boiling Point 288.3 °C at 760 mmHg
Molecular Weight 139.2
Flash Point 128.2 °C
Transport Information
Appearance
Safety 26-36/37/39-45
Risk Codes 22-34
Molecular Structure
Hazard Symbols C
Synonyms Imidazole,1-(3-aminopropyl)-2-methyl- (7CI);1-(3-Aminopropyl)-2-methylimidazole;1-(3'-Aminopropyl)-2-methylimidazole;3-(2-Methylimidazol-1-yl)propylamine;
PSA 43.84000
LogP 1.24060

2-Methyl-1H-imidazole-1-propanamine Specification

The 2-Methyl-1H-imidazole-1-propanamine with its cas register number is 2258-21-1. It also can be called as 1H-Imidazole-1-propanamine,2-methyl- and the Systematic name about this chemical is 3-(2-methyl-1H-imidazol-1-yl)propan-1-amine.

Physical properties about 2-Methyl-1H-imidazole-1-propanamine are: (1)ACD/LogP: -0.49; (2)ACD/LogD (pH 5.5): -4.52; (3)ACD/LogD (pH 7.4): -3.23; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 21.06Å²; (12)Index of Refraction: 1.553; (13)Molar Refractivity: 40.99 cm³; (14)Molar Volume: 127.9 cm³; (15)Polarizability: 16.25x10^-24cm³; (16)Surface Tension: 40.7 dyne/cm; (17)Enthalpy of Vaporization: 52.75 kJ/mol; (18)Vapour Pressure: 0.00236 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1ccn(c1C)CCCN
(2)InChI: InChI=1/C7H13N3/c1-7-9-4-6-10(7)5-2-3-8/h4,6H,2-3,5,8H2,1H3
(3)InChIKey: NDUDHWBKFFJGMA-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C7H13N3/c1-7-9-4-6-10(7)5-2-3-8/h4,6H,2-3,5,8H2,1H3
(5)Std. InChIKey: NDUDHWBKFFJGMA-UHFFFAOYSA-N

Product Name

3-(2-METHYL-1H-IMIDAZOL-1-YL)PROPYLAMINE

2-Methyl-1H-imidazole-1-propanamine Specification

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