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225647-12-1

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Basic Information
CAS No.: 225647-12-1
Name: 4,5,6,7-TETRAHYDRO-1H-BENZOIMIDAZOLE
Molecular Structure:
Molecular Structure of 225647-12-1 (4,5,6,7-TETRAHYDRO-1H-BENZOIMIDAZOLE)
Formula: C7H10N2
Molecular Weight: 122.17
Synonyms: IFLAB-BB F3055-0232;AKOS BBS-00000164;4,5,6,7-Tetrahydro-1h-benzoimidazole;
Density: 1.133 g/cm3
Boiling Point: 335 °C at 760 mmHg
Flash Point: 183.6 °C
PSA: 28.68000
LogP: 1.28850
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Specification

The CAS register number of 2H-Benzimidazole,4,5,6,7-tetrahydro- is 225647-12-1. The IUPAC name about this chemical is 4,5,6,7-tetrahydro-1H-benzimidazole. The molecular formula about this chemical is C7H10N2 and the molecular weight is 122.17. It belongs to the following product categories which include Imidazol & Benzimidazole and so on.

Physical properties about 2H-Benzimidazole,4,5,6,7-tetrahydro- are: (1)ACD/LogP: 1.53; (2)ACD/LogD (pH 7.4): 0.65; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1.14; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 21.58; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)Polar Surface Area: 17.82 Å2; (10)Index of Refraction: 1.573; (11)Molar Refractivity: 35.56 cm3; (12)Molar Volume: 107.8 cm3; (13)Polarizability: 14.09x10-24cm3; (14)Surface Tension: 50.4 dyne/cm; (15)Density: 1.133 g/cm3; (16)Flash Point: 183.6 °C; (17)Enthalpy of Vaporization: 55.51 kJ/mol; (18)Boiling Point: 335 °C at 760 mmHg; (19)Vapour Pressure: 0.00024 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c2c(nc1)CCCC2
(2)InChI: InChI=1/C7H10N2/c1-2-4-7-6(3-1)8-5-9-7/h5H,1-4H2,(H,8,9)
(3)InChIKey: KAWYASGZISVRAL-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C7H10N2/c1-2-4-7-6(3-1)8-5-9-7/h5H,1-4H2,(H,8,9)
(5)Std. InChIKey: KAWYASGZISVRAL-UHFFFAOYSA-N