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CAS No.: | 67382-11-0 |
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Name: | 2-CHLORO-3-ACETAMIDOBENZOFURAN |
Molecular Structure: | |
Formula: | C10H8ClNO2 |
Molecular Weight: | 209.629 |
Synonyms: | 2-Chloro-3-acetamidobenzofuran;acetamide, N-(2-chloro-3-benzofuranyl)-;2-Chloro-3-acetamidobenzofuran;acetamide, N-(2-chloro-3-benzofuranyl)-; |
Density: | 1.384 g/cm3 |
Melting Point: | 180-181 °C(Solv: chloroform (67-66-3); hexane (110-54-3)) |
Boiling Point: | 391.2 °C at 760 mmHg |
Flash Point: | 190.4 °C |
PSA: | 42.24000 |
LogP: | 3.11760 |
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The Acetamide,N-(2-chloro-3-benzofuranyl)-, with the CAS registry number 67382-11-0, has the systematic name of N-(2-chloro-1-benzofuran-3-yl)acetamide. It is also called 2-Chloro-3-acetamidobenzofuran. And the molecular formula of this chemical is C10H8ClNO2.
The physical properties of Acetamide,N-(2-chloro-3-benzofuranyl)- are as following: (1)ACD/LogP: 1.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.73; (4)ACD/LogD (pH 7.4): 1.73; (5)ACD/BCF (pH 5.5): 12.19; (6)ACD/BCF (pH 7.4): 12.19; (7)ACD/KOC (pH 5.5): 208.47; (8)ACD/KOC (pH 7.4): 208.47; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 33.45 Å2; (13)Index of Refraction: 1.655; (14)Molar Refractivity: 55.56 cm3; (15)Molar Volume: 151.3 cm3; (16)Polarizability: 22.02×10-24cm3; (17)Surface Tension: 51 dyne/cm; (18)Density: 1.384 g/cm3; (19)Flash Point: 190.4 °C; (20)Enthalpy of Vaporization: 64.07 kJ/mol; (21)Boiling Point: 391.2 °C at 760 mmHg; (22)Vapour Pressure: 2.51E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1c2ccccc2oc1Cl)C
(2)InChI: InChI=1/C10H8ClNO2/c1-6(13)12-9-7-4-2-3-5-8(7)14-10(9)11/h2-5H,1H3,(H,12,13)
(3)InChIKey: QYOQFUJUEHRRNI-UHFFFAOYAV