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CAS No.: | 38880-90-9 |
---|---|
Name: | 4'-Amino-2'-hydroxybenzanilide |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C13H12N2O2 |
Molecular Weight: | 228.25 |
Synonyms: | 2-Benzamido-5-aminophenol;5-Amino-2-benzamidophenol;NSC 157435; |
Density: | 1.35g/cm3 |
Boiling Point: | 339.3 °C at 760 mmHg |
Flash Point: | 159 °C |
PSA: | 75.35000 |
LogP: | 2.88090 |
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The Benzamide,N-(4-amino-2-hydroxyphenyl)-, with CAS registry number 38880-90-9, has the systematic name of N-(4-amino-2-hydroxyphenyl)benzamide. Besides this, it is also called 4'-Amino-2'-hydroxybenzanilide. And the chemical formula of this chemical is C13H12N2O2.
Physical properties of Benzamide,N-(4-amino-2-hydroxyphenyl)-: (1)ACD/LogP: 1.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.01; (4)ACD/LogD (pH 7.4): 1.08; (5)ACD/BCF (pH 5.5): 3.34; (6)ACD/BCF (pH 7.4): 3.87; (7)ACD/KOC (pH 5.5): 78.94; (8)ACD/KOC (pH 7.4): 91.33; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 32.78 Å2; (13)Index of Refraction: 1.722; (14)Molar Refractivity: 66.94 cm3; (15)Molar Volume: 169 cm3; (16)Polarizability: 26.53×10-24cm3; (17)Surface Tension: 69.3 dyne/cm; (18)Density: 1.35 g/cm3; (19)Flash Point: 159 °C; (20)Enthalpy of Vaporization: 60.59 kJ/mol; (21)Boiling Point: 339.3 °C at 760 mmHg; (22)Vapour Pressure: 4.71E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccc(cc1O)N)c2ccccc2
(2)InChI: InChI=1/C13H12N2O2/c14-10-6-7-11(12(16)8-10)15-13(17)9-4-2-1-3-5-9/h1-8,16H,14H2,(H,15,17)
(3)InChIKey: XBSZSDGIVSNDOF-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C13H12N2O2/c14-10-6-7-11(12(16)8-10)15-13(17)9-4-2-1-3-5-9/h1-8,16H,14H2,(H,15,17)
(5)Std. InChIKey: XBSZSDGIVSNDOF-UHFFFAOYSA-N