CAS No.60125-24-8,FEMA 3181 Suppliers

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Basic Information

Molecular Structure:
CAS No.:	60125-24-8
Name:	FEMA 3181

Formula:	C₁₀H₁₀O₂
Molecular Weight:	162.188
Synonyms:	2-Propenal,3-(2-methoxyphenyl)-, (E)-;(2E)-3-(2-Methoxyphenyl)-2-propenal;(E)-2-Methoxycinnamaldehyde;(E)-3-(2-Methoxyphenyl)-2-propenal;trans-2-Methoxycinnamaldehyde;trans-o-Methoxycinnamaldehyde;
EINECS:	216-131-3
Density:	1.068g/cm³
Melting Point:	44-46ºC
Boiling Point:	334.8 °C at 760 mmHg
Flash Point:	134.4 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-37/39
PSA:	26.30000
LogP:	1.90730

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Specification

The 2-Propenal,3-(2-methoxyphenyl)-, (2E)-, with CAS registry number 60125-24-8, belongs to the following product categories: (1)Aldehydes; (2)C10 to C21; (3)Carbonyl Compounds. It has the systematic name of (2E)-3-(2-methoxyphenyl)prop-2-enal. And the chemical formula of this chemical is C₁₀H₁₀O₂. What's more, its EINECS is 216-131-3.

Physical properties of 2-Propenal,3-(2-methoxyphenyl)-, (2E)-: (1)ACD/LogP: 2.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.13; (4)ACD/LogD (pH 7.4): 2.13; (5)ACD/BCF (pH 5.5): 24.42; (6)ACD/BCF (pH 7.4): 24.42; (7)ACD/KOC (pH 5.5): 342.75; (8)ACD/KOC (pH 7.4): 342.75; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.559; (14)Molar Refractivity: 49 cm3; (15)Molar Volume: 151.7 cm³; (16)Polarizability: 19.42×10^-24cm³; (17)Surface Tension: 37.6 dyne/cm; (18)Density: 1.068 g/cm³; (19)Flash Point: 134.4 °C; (20)Enthalpy of Vaporization: 57.78 kJ/mol; (21)Boiling Point: 334.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000125 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 2-Propenal,3-(2-methoxyphenyl)-, (2E)- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C\C=C\c1ccccc1OC
(2)InChI: InChI=1/C10H10O2/c1-12-10-7-3-2-5-9(10)6-4-8-11/h2-8H,1H3/b6-4+
(3)InChIKey: KKVZAVRSVHUSPL-GQCTYLIABC
(4)Std. InChI: InChI=1S/C10H10O2/c1-12-10-7-3-2-5-9(10)6-4-8-11/h2-8H,1H3/b6-4+
(5)Std. InChIKey: KKVZAVRSVHUSPL-GQCTYLIASA-N