Phenol,2,4-diethyl- supplier

Name
2,4-diethylphenol
EINECS 213-318-1
CAS No. 936-89-0
Article Data15
CAS DataBase
Density 0.978g/cm³
Solubility
Melting Point 46.81°C (estimate)
Formula C₁₀H₁₄O
Boiling Point 237.7 °C at 760 mmHg
Molecular Weight 150.221
Flash Point 106.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,4-Diethylphenol;
PSA 20.23000
LogP 2.51700

Phenol,2,4-diethyl- Specification

The Phenol,2,4-diethyl-, with CAS registry number 936-89-0, has the systematic name of 2,4-diethylphenol. Its molecular weight is 150.21756. And the chemical formula of this chemical is C₁₀H₁₄O. What's more, its EINECS is 213-318-1.

Physical properties of Phenol,2,4-diethyl-: (1)ACD/LogP: 3.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.46; (4)ACD/LogD (pH 7.4): 3.46; (5)ACD/BCF (pH 5.5): 253.08; (6)ACD/BCF (pH 7.4): 252.93; (7)ACD/KOC (pH 5.5): 1827.49; (8)ACD/KOC (pH 7.4): 1826.39; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 47.23 cm³; (15)Molar Volume: 153.4 cm³; (16)Polarizability: 18.72×10^-24cm³; (17)Surface Tension: 35.8 dyne/cm; (18)Density: 0.978 g/cm³; (19)Flash Point: 106.2 °C; (20)Enthalpy of Vaporization: 49.38 kJ/mol; (21)Boiling Point: 237.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0286 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(cc1CC)CC
(2)InChI: InChI=1/C10H14O/c1-3-8-5-6-10(11)9(4-2)7-8/h5-7,11H,3-4H2,1-2H3
(3)InChIKey: LMLAXOBGXCTWBJ-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C10H14O/c1-3-8-5-6-10(11)9(4-2)7-8/h5-7,11H,3-4H2,1-2H3
(5)Std. InChIKey: LMLAXOBGXCTWBJ-UHFFFAOYSA-N

Product Name

2,4-diethylphenol

Phenol,2,4-diethyl- Specification

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