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CAS No.: | 26216-10-4 |
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Name: | 1-(4-HYDROXY-2,5-DIMETHYL-PHENYL)-ETHANONE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C10H12O2 |
Molecular Weight: | 164.204 |
Synonyms: | Acetophenone,4'-hydroxy-2',5'-dimethyl- (7CI,8CI);2,5-Dimethyl-4-acetylphenol;2,5-Dimethyl-4-hydroxyacetophenone;4-Hydroxy-2,5-dimethylacetophenone;NSC173995; |
Density: | 1.08 g/cm3 |
Melting Point: | 130-131 °C |
Boiling Point: | 315 °C at 760 mmHg |
Flash Point: | 133.4 °C |
PSA: | 37.30000 |
LogP: | 2.21160 |
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The Ethanone,1-(4-hydroxy-2,5-dimethylphenyl)-, with the CAS registry number 26216-10-4, is also known as 2,5-Dimethyl-4-hydroxyacetophenone. This chemical's molecular formula is C10H12O2 and molecular weight is 164.20108. What's more, its IUPAC name and systematic name are the same which is called 1-(4-Hydroxy-2,5-dimethylphenyl)ethanone.
Physical properties about Ethanone,1-(4-hydroxy-2,5-dimethylphenyl)-: (1)ACD/LogP: 2.34; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.541; (8)Molar Refractivity: 47.81 cm3; (9)Molar Volume: 151.9 cm3; (10)Surface Tension: 40.2 dyne/cm; (11)Density: 1.08 g/cm3; (12)Flash Point: 133.4 °C; (13)Enthalpy of Vaporization: 57.84 kJ/mol; (14)Boiling Point: 315 °C at 760 mmHg; (15)Vapour Pressure: 0.000243 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1c(cc(O)c(c1)C)C)C
(2) InChI: InChI=1/C10H12O2/c1-6-5-10(12)7(2)4-9(6)8(3)11/h4-5,12H,1-3H3
(3) InChIKey: MHQHNHNWOMRDKM-UHFFFAOYAU