Products Categories
CAS No.: | 82389-32-0 |
---|---|
Name: | oxirane-2,3-diylbis(phenylmethanone) |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C16H12O3 |
Molecular Weight: | 252.269 |
Synonyms: | Methanone, 2,3-oxiranediylbis[phenyl-, trans-;NSC 220062; |
Density: | 1.272 g/cm3 |
Boiling Point: | 419.9 °C at 760 mmHg |
Flash Point: | 188.2 °C |
What can I do for you?
Get Best Price
The Methanone, (2R,3R)-2,3-oxiranediylbis[phenyl-, rel- (9CI), with the CAS registry number 82389-32-0, is also known as Oxirane-2,3-diylbis(phenylmethanone). This chemical's molecular formula is C16H12O3 and molecular weight is 252.2647. What's more, its IUPAC name is called (3-Benzoyloxiran-2-yl)-phenylmethanone.
Physical properties about Methanone, (2R,3R)-2,3-oxiranediylbis[phenyl-, rel- (9CI) are: (1)ACD/LogP: 2.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.36; (4)ACD/LogD (pH 7.4): 2.36; (5)ACD/BCF (pH 5.5): 36.76; (6)ACD/BCF (pH 7.4): 36.76; (7)ACD/KOC (pH 5.5): 459.33; (8)ACD/KOC (pH 7.4): 459.33; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 46.67 Å2; (13)Index of Refraction: 1.625; (14)Molar Refractivity: 70.11 cm3; (15)Molar Volume: 198.3 cm3; (16)Surface Tension: 56.6 dyne/cm; (17)Density: 1.272 g/cm3; (18)Flash Point: 188.2 °C; (19)Enthalpy of Vaporization: 67.36 kJ/mol; (20)Boiling Point: 419.9 °C at 760 mmHg; (21)Vapour Pressure: 2.94E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1ccccc1)C3OC3C(=O)c2ccccc2
(2) InChI: InChI=1/C16H12O3/c17-13(11-7-3-1-4-8-11)15-16(19-15)14(18)12-9-5-2-6-10-12/h1-10,15-16H
(3) InChIKey: ADFLDJCSCJHDEY-UHFFFAOYAJ