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| CAS No.: | 42465-53-2 |
|---|---|
| Name: | 2'AMINO-4'-METHOXYACETOPHENONE |
| Article Data: | 24 |
| Molecular Structure: | |
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| Formula: | C9H11NO2 |
| Molecular Weight: | 165.192 |
| Synonyms: | Acetophenone,2'-amino-4'-methoxy- (7CI);1-(2-Amino-4-methoxyphenyl)ethanone;4'-Methoxy-2'-aminoacetophenone; |
| Density: | 1.111 g/cm3 |
| Melting Point: | 119-120 °C |
| Boiling Point: | 315.4 °C at 760 mmHg |
| Flash Point: | 166 °C |
| PSA: | 52.32000 |
| LogP: | 2.06120 |
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- Total:32 Page 1 of 1 1
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Specification
The Ethanone,1-(2-amino-4-methoxyphenyl)-, with the CAS registry number 42465-53-2, is also known as NSC42439. This chemical's molecular formula is C9H11NO2 and molecular weight is 165.078979. Its IUPAC name is called 2-amino-1-(4-methoxyphenyl)ethanone.
Physical properties of Ethanone,1-(2-amino-4-methoxyphenyl)-: (1)ACD/LogP: 0.89; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 4; (5)Index of Refraction: 1.538; (6)Molar Refractivity: 46.49 cm3; (7)Molar Volume: 148.6 cm3; (8)Surface Tension: 41.8 dyne/cm; (9)Density: 1.111 g/cm3; (10)Flash Point: 166 °C; (11)Enthalpy of Vaporization: 55.66 kJ/mol; (12)Boiling Point: 315.4 °C at 760 mmHg; (13)Vapour Pressure: 0.000439 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=CC=C(C=C1)C(=O)CN
(2)InChI: InChI=1S/C9H11NO2/c1-12-8-4-2-7(3-5-8)9(11)6-10/h2-5H,6,10H2,1H3
(3)InChIKey: CNYAWQABGNEMFC-UHFFFAOYSA-N