(2E)-3-(2-Methylphenyl)-2-propenal supplier

Name
2-METHYLCINNAMALDEHYDE
EINECS
CAS No. 93614-78-9
Article Data58
CAS DataBase
Density 1.015 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₀O
Boiling Point 259.691 °C at 760 mmHg
Molecular Weight 146.189
Flash Point 91.98 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Propenal,3-(2-methylphenyl)-, (E)-;(2E)-3-(2-Methylphenyl)acrylaldehyde;2-Methylcinnamaldehyde;2-propenal, 3-(2-methylphenyl)-, (2E)-;(E)-3-o-tolylacrylaldehyde;2-Methyl Cinnamic Aldehyde;3-o-tolylacrylaldehyde;
PSA 17.07000
LogP 2.20710

(2E)-3-(2-Methylphenyl)-2-propenal Specification

The 2-Propenal,3-(2-methylphenyl)-, (2E)-, with the CAS registry number 93614-78-9, has the systematic name of (2E)-3-(2-methylphenyl)prop-2-enal. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₁₀H₁₀O.

The characteristics of 2-Propenal,3-(2-methylphenyl)-, (2E)- are as followings: (1)ACD/LogP: 2.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 54; (6)ACD/BCF (pH 7.4): 54; (7)ACD/KOC (pH 5.5): 606; (8)ACD/KOC (pH 7.4): 606; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.569; (14)Molar Refractivity: 47.154 cm³; (15)Molar Volume: 144.003 cm³; (16)Polarizability: 18.693×10^-24cm³; (17)Surface Tension: 37.671 dyne/cm; (18)Density: 1.015 g/cm³; (19)Flash Point: 91.98 °C; (20)Enthalpy of Vaporization: 49.735 kJ/mol; (21)Boiling Point: 259.691 °C at 760 mmHg; (22)Vapour Pressure: 0.013 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C/C=C/c1ccccc1C
(2)InChI: InChI=1/C10H10O/c1-9-5-2-3-6-10(9)7-4-8-11/h2-8H,1H3/b7-4+
(3)InChIKey: ZAUAFFKABKNGKX-QPJJXVBHBJ

Product Name

2-METHYLCINNAMALDEHYDE

(2E)-3-(2-Methylphenyl)-2-propenal Specification

Related Products

Hot Products