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2-Amino-5,6-dimethylbenzimidazole

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Name

2-Amino-5,6-dimethylbenzimidazole

EINECS 249-430-2
CAS No. 29096-75-1 Density 1.24 g/cm3
PSA 54.70000 LogP 2.34310
Solubility N/A Melting Point 220-223 °C (dec.)(lit.)
Formula C9H11N3 Boiling Point 389.3 °C at 760 mmHg
Molecular Weight 161.206 Flash Point 217.7 °C
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 29096-75-1 (2-Amino-5,6-dimethylbenzimidazole) Hazard Symbols IrritantXi
Synonyms

Benzimidazole,2-amino-5,6-dimethyl- (7CI,8CI);2-Amino-5,6-dimethylbenzimidazole;5,6-Dimethyl-1H-benzimidazol-2-amine;5,6-Dimethyl-2-aminobenzimidazole;NSC208659;

Article Data 13

2-Amino-5,6-dimethylbenzimidazole Specification

The 2-Amino-5,6-dimethylbenzimidazole is an organic compound with the formula C9H11N3. The systematic name of this chemical is 5,6-dimethyl-1H-benzimidazol-2-amine. With the CAS registry number 29096-75-1, it is also named as 1H-benzimidazol-2-amine, 5,6-dimethyl-. The product's categories are Benzimidazole; Pharmacetical; A; Stains and Dyes; Stains & Dyes, A to. Besides, it should be stored in a closed cool and dry place.

Physical properties about 2-Amino-5,6-dimethylbenzimidazole are: (1)ACD/LogP: 1.70; (2)ACD/LogD (pH 5.5): -0.62; (3)ACD/LogD (pH 7.4): 0.76; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1.33; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 23.12; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)Polar Surface Area: 21.06 Å2; (11)Index of Refraction: 1.705; (12)Molar Refractivity: 50.5 cm3; (13)Molar Volume: 129.9 cm3; (14)Polarizability: 20.02×10-24cm3; (15)Surface Tension: 62.9 dyne/cm; (16)Density: 1.24 g/cm3; (17)Flash Point: 217.7 °C; (18)Enthalpy of Vaporization: 63.87 kJ/mol; (19)Boiling Point: 389.3 °C at 760 mmHg; (20)Vapour Pressure: 2.87E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: n2c1cc(c(cc1nc2N)C)C
(2)InChI: InChI=1/C9H11N3/c1-5-3-7-8(4-6(5)2)12-9(10)11-7/h3-4H,1-2H3,(H3,10,11,12)
(3)InChIKey: YPFQISHSXCFZMU-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C9H11N3/c1-5-3-7-8(4-6(5)2)12-9(10)11-7/h3-4H,1-2H3,(H3,10,11,12)
(5)Std. InChIKey: YPFQISHSXCFZMU-UHFFFAOYSA-N

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