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CAS No.: | 57221-63-3 |
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Name: | 2-[3-(4-HYDROXYPHENYL)ACRYLOYL]NAPHTHALENE |
Molecular Structure: | |
Formula: | C19H14O2 |
Molecular Weight: | 274.319 |
Synonyms: | 3-(4-Hydroxyphenyl)-1-(2-naphthyl)-2-propen-1-one;3-(4-Hydroxyphenyl)-1-(naphthalen-2-yl)prop-2-en-1-one;2-[3-(4-Hydroxyphenyl)acryloyl]naphthalene; |
Density: | 1.233 g/cm3 |
Boiling Point: | 485.7 °C at 760 mmHg |
Flash Point: | 206.2 °C |
Hazard Symbols: | Xi |
PSA: | 37.30000 |
LogP: | 4.44150 |
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The 2-Propen-1-one,3-(4-hydroxyphenyl)-1-(2-naphthalenyl)-, with the CAS registry number 57221-63-3, is also known as 3-(4-Hydroxyphenyl)-1-(2-naphthyl)-2-propen-1-one. This chemical's molecular formula is C19H14O2 and molecular weight is 274.31. What's more, its systematic name is (2E)-3-(4-hydroxyphenyl)-1-naphthalen-2-ylprop-2-en-1-one. When you are using this chemical, please be cautious about it. It may cause inflammation to the skin or other mucous membranes.
Physical properties of 2-Propen-1-one,3-(4-hydroxyphenyl)-1-(2-naphthalenyl)- are: (1)ACD/LogP: 4.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.71; (4)ACD/LogD (pH 7.4): 4.71; (5)ACD/BCF (pH 5.5): 2227.29; (6)ACD/BCF (pH 7.4): 2214.63; (7)ACD/KOC (pH 5.5): 8668.14; (8)ACD/KOC (pH 7.4): 8618.88; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.709; (14)Molar Refractivity: 86.83 cm3; (15)Molar Volume: 222.3 cm3; (16)Polarizability: 34.42×10-24cm3; (17)Surface Tension: 56.5 dyne/cm; (18)Density: 1.233 g/cm3; (19)Flash Point: 206.2 °C; (20)Enthalpy of Vaporization: 77.98 kJ/mol; (21)Boiling Point: 485.7 °C at 760 mmHg; (22)Vapour Pressure: 4.66E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(/C=C/c1ccc(O)cc1)c3cc2ccccc2cc3
(2)Std. InChI: InChI=1S/C19H14O2/c20-18-10-5-14(6-11-18)7-12-19(21)17-9-8-15-3-1-2-4-16(15)13-17/h1-13,20H/b12-7+
(3)Std. InChIKey: VUXHIPRYBOEAAE-KPKJPENVSA-N