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1H-Imidazol-2-amine, 4,5-dimethyl-

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Name

1H-Imidazol-2-amine, 4,5-dimethyl-

EINECS N/A
CAS No. 13805-21-5 Density 1.16 g/cm3
PSA 54.70000 LogP 1.18990
Solubility N/A Melting Point N/A
Formula C5H9N3 Boiling Point 319.901 °C at 760 mmHg
Molecular Weight 111.147 Flash Point 173.232 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 13805-21-5 (1H-Imidazol-2-amine,4,5-dimethyl-(9CI)) Hazard Symbols N/A
Synonyms

4,5-Dimethyl-1H-imidazol-2-amine;2-Amnio-4,5-dimethyl-1H-imidazole;

Article Data 9

1H-Imidazol-2-amine, 4,5-dimethyl- Specification

The 1H-Imidazol-2-amine, 4,5-dimethyl-, with the CAS registry number 13805-21-5, is also known as 2-Amnio-4,5-dimethyl-1H-imidazole. It belongs to the product category of Variousamine. This chemical's molecular formula is C5H9N3 and molecular weight is 111.15. What's more, its systematic name is 4,5-dimethyl-1H-imidazol-2-amine. 

Physical properties of 1H-Imidazol-2-amine, 4,5-dimethyl- are: (1)ACD/LogP: 0.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2; (4)ACD/LogD (pH 7.4): -2; (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: 3; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 54.7 Å2; (13)Index of Refraction: 1.597; (14)Molar Refractivity: 32.663 cm3; (15)Molar Volume: 95.81 cm3; (16)Polarizability: 12.949×10-24cm3; (17)Surface Tension: 56.046 dyne/cm; (18)Density: 1.16 g/cm3; (19)Flash Point: 173.232 °C; (20)Enthalpy of Vaporization: 56.153 kJ/mol; (21)Boiling Point: 319.901 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1nc(N)nc1C
(2)InChI: InChI=1S/C5H9N3/c1-3-4(2)8-5(6)7-3/h1-2H3,(H3,6,7,8)
(3)InChIKey: JUWWVCSNLLWQBL-UHFFFAOYSA-N

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