Basic information
- Name:
Ethanone,1-(2-amino-5-hydroxyphenyl)-
- Superlist Name:
- 2'-Amino-5'-hydroxyacetophenone
- CAS No.:
30954-71-3
- Molecular Structure:
- Formula:
- C8H9NO2
- Molecular Weight:
- 151.1626
- Synonyms:
- Acetophenone,2'-amino-5'-hydroxy- (8CI);2-Amino-5-hydroxyacetophenone;2'-Amino-5'-hydroxyacetophenone;
- Density:
- 1.242 g/cm3
- Boiling Point:
- 358.5 °C at 760 mmHg
- Flash Point:
- 170.6 °C
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Specification
The Ethanone,1-(2-amino-5-hydroxyphenyl)-, with the CAS registry number 30954-71-3, is also known as 2-Amino-5-hydroxyacetophenone. It belongs to the product category of Acetylgroup. This chemical's molecular formula is C8H9NO2 and molecular weight is 151.063329. Its IUPAC name is called 1-(2-amino-5-hydroxyphenyl)ethanone.
Physical properties of Ethanone,1-(2-amino-5-hydroxyphenyl)-: (1)ACD/LogP: 0.86; (2)ACD/LogD (pH 5.5): 0.86; (3)ACD/LogD (pH 7.4): 0.85; (4)ACD/BCF (pH 5.5): 2.63; (5)ACD/BCF (pH 7.4): 2.62; (6)ACD/KOC (pH 5.5): 69.56; (7)ACD/KOC (pH 7.4): 69.11; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.613; (12)Molar Refractivity: 42.39 cm3; (13)Molar Volume: 121.6 cm3; (14)Surface Tension: 56.3 dyne/cm; (15)Density: 1.242 g/cm3; (16)Flash Point: 170.6 °C; (17)Enthalpy of Vaporization: 62.78 kJ/mol; (18)Boiling Point: 358.5 °C at 760 mmHg; (19)Vapour Pressure: 1.23E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)C1=C(C=CC(=C1)O)N
(2)InChI: InChI=1S/C8H9NO2/c1-5(10)7-4-6(11)2-3-8(7)9/h2-4,11H,9H2,1H3
(3)InChIKey: UAYRCOSFOXJQAB-UHFFFAOYSA-N