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CAS No.: | 143268-49-9 |
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Name: | Benzimidazoline,2-isopropylidene-1,3-dimethyl- |
Molecular Structure: | |
Formula: | C12H16N2 |
Molecular Weight: | 188.27 |
Synonyms: | Benzimidazoline,2-isopropylidene-1,3-dimethyl- |
Density: | 1.031 g/cm3 |
Boiling Point: | 271.6 °C at 760 mmHg |
Flash Point: | 110.6 °C |
PSA: | 9.86000 |
LogP: | 1.98840 |
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This chemical is called Benzimidazoline, 2-isopropylidene-1,3-dimethyl-, and its systematic name is 1,3-dimethyl-2-(propan-2-ylidene)-2,3-dihydro-1H-benzimidazole. With the molecular formula of C12H16N2, its molecular weight is 188.27. The CAS registry number of this chemical is 143268-49-9.
Other characteristics of the Benzimidazoline, 2-isopropylidene-1,3-dimethyl- can be summarised as followings: (1)ACD/LogP: 2.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.21; (4)ACD/LogD (pH 7.4): 2.21; (5)ACD/BCF (pH 5.5): 27.96; (6)ACD/BCF (pH 7.4): 28.08; (7)ACD/KOC (pH 5.5): 377.14; (8)ACD/KOC (pH 7.4): 378.79; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.562; (14)Molar Refractivity: 59.23 cm3; (15)Molar Volume: 182.5 cm3; (16)Polarizability: 23.48×10-24cm3; (17)Surface Tension: 35.4 dyne/cm; (18)Density: 1.031 g/cm3; (19)Flash Point: 110.6 °C; (20)Enthalpy of Vaporization: 50.98 kJ/mol; (21)Boiling Point: 271.6 °C at 760 mmHg; (22)Vapour Pressure: 0.00639 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: c1cccc2c1N(\C(=C(\C)C)N2C)C
2.InChI: InChI=1/C12H16N2/c1-9(2)12-13(3)10-7-5-6-8-11(10)14(12)4/h5-8H,1-4H3
3.InChIKey: QJFVNVGUTOOLOA-UHFFFAOYAM