3-Methoxy-2,3-diphenylacrylonitrile supplier

Name
3-Methoxy-2,3-diphenylacrylonitrile
EINECS
CAS No. 55271-99-3
Density 1.109 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₃NO
Boiling Point 391.3 °C at 760 mmHg
Molecular Weight 235.285
Flash Point 164.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Methoxy-2,3-diphenylprop-2-enenitrile;
PSA
LogP

3-Methoxy-2,3-diphenylacrylonitrile Specification

The CAS registry number of 3-Methoxy-2,3-diphenylacrylonitrile is 55271-99-3. This chemical's molecular formula is C₁₆H₁₃NO and molecular weight is 235.2805. What's more, its systematic name is called 3-Methoxy-2,3-diphenylprop-2-enenitrile.

Physical properties about 3-Methoxy-2,3-diphenylacrylonitrile are: (1)ACD/LogP: 3.71; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.71; (4)ACD/LogD (pH 7.4): 3.71; (5)ACD/BCF (pH 5.5): 385.94; (6)ACD/BCF (pH 7.4): 385.94; (7)ACD/KOC (pH 5.5): 2471.91; (8)ACD/KOC (pH 7.4): 2471.91; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 33.02 Å²; (13)Index of Refraction: 1.592; (14)Molar Refractivity: 71.85 cm³; (15)Molar Volume: 212.1 cm³; (16)Polarizability: 28.48×10^-24 cm³; (17)Surface Tension: 45.2 dyne/cm; (18)Density: 1.109 g/cm³; (19)Flash Point: 164.6 °C; (20)Enthalpy of Vaporization: 64.09 kJ/mol; (21)Boiling Point: 391.3 °C at 760 mmHg; (22)Vapour Pressure: 2.49E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: N#CC(=C(OC)c1ccccc1)c2ccccc2
(2) InChI: InChI=1/C16H13NO/c1-18-16(14-10-6-3-7-11-14)15(12-17)13-8-4-2-5-9-13/h2-11H,1H3
(3) InChIKey: IBUZFMSKKIVLBZ-UHFFFAOYAE

Product Name

3-Methoxy-2,3-diphenylacrylonitrile

3-Methoxy-2,3-diphenylacrylonitrile Specification

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