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Keywords
Reductol AY 25712 Acifran
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- Application:This chemical is called Acifran [USAN:INN], and its systematic name is 2-Furancarboxylic acid, 4,5-dihydro-5-methyl-4-oxo-5-phenyl- , (+-)-. With the molecular formula of C12H10O4, its molecular weig
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- Transportation:This chemical is called Acifran [USAN:INN], and its systematic name is 2-Furancarboxylic acid, 4,5-dihydro-5-methyl-4-oxo-5-phenyl- , (+-)-. With the molecular formula of C12H10O4, its molecular weig
Superiority:
This chemical is called Acifran [USAN:INN], and its systematic name is 2-Furancarboxylic acid, 4,5-dihydro-5-methyl-4-oxo-5-phenyl-
, (+-)-. With the molecular formula of C12H10O4, its molecular weight is 218.21. The CAS registry number of this chemical is 72420-38-3. Additionally, its product category is Miscellaneous Compounds.
Other characteristics of the Acifran [USAN:INN] can be summarised as followings: (1)ACD/LogP: 1.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.72; (4)ACD/LogD (pH 7.4): -2.32; (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: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 52.6 Å2; (13)Index of Refraction: 1.591; (14)Molar Refractivity: 54.94 cm3; (15)Molar Volume: 162.3 cm3; (16)Polarizability: 21.78×10-24cm3; (17)Surface Tension: 55 dyne/cm; (18)Density: 1.343 g/cm3; (19)Flash Point: 149.4 °C; (20)Enthalpy of Vaporization: 66.07 kJ/mol; (21)Boiling Point: 378.4 °C at 760 mmHg; (22)Vapour Pressure: 2.12E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C2\C=C(/OC2(c1ccccc1)C)C(=O)O
2.InChI: InChI=1/C12H10O4/c1-12(8-5-3-2-4-6-8)10(13)7-9(16-12)11(14)15/h2-7H,1H3,(H,14,15)
3.InChIKey: DFDGRKNOFOJBAJ-UHFFFAOYAEA
The toxicity data is as follows:
Details:
This chemical is called Acifran [USAN:INN], and its systematic name is 2-Furancarboxylic acid, 4,5-dihydro-5-methyl-4-oxo-5-phenyl-
, (+-)-. With the molecular formula of C12H10O4, its molecular weight is 218.21. The CAS registry number of this chemical is 72420-38-3. Additionally, its product category is Miscellaneous Compounds.
Other characteristics of the Acifran [USAN:INN] can be summarised as followings: (1)ACD/LogP: 1.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.72; (4)ACD/LogD (pH 7.4): -2.32; (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: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 52.6 Å2; (13)Index of Refraction: 1.591; (14)Molar Refractivity: 54.94 cm3; (15)Molar Volume: 162.3 cm3; (16)Polarizability: 21.78×10-24cm3; (17)Surface Tension: 55 dyne/cm; (18)Density: 1.343 g/cm3; (19)Flash Point: 149.4 °C; (20)Enthalpy of Vaporization: 66.07 kJ/mol; (21)Boiling Point: 378.4 °C at 760 mmHg; (22)Vapour Pressure: 2.12E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C2\C=C(/OC2(c1ccccc1)C)C(=O)O
2.InChI: InChI=1/C12H10O4/c1-12(8-5-3-2-4-6-8)10(13)7-9(16-12)11(14)15/h2-7H,1H3,(H,14,15)
3.InChIKey: DFDGRKNOFOJBAJ-UHFFFAOYAEA
The toxicity data is as follows:
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