-
Name
4,4'-[(1R,2S)-1,2-Diethylethylene]di(o-cresol)
- EINECS
- CAS No. 10465-10-8
- Density 1.066g/cm3
- Solubility
- Melting Point
- Formula C20H26 O2
- Boiling Point 418.9°C at 760 mmHg
- Molecular Weight 298.46
- Flash Point 185.9°C
- Transport Information
- Appearance
- Safety Experimental reproductive effects. When heated to decomposition it emits acrid smoke and irritating fumes.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Phenol,4,4'-(1,2-diethyl-1,2-ethanediyl)bis[2-methyl-, (R*,S*)- (9CI); o-Cresol,4,4'-(1,2-diethylethylene)di-, meso- (8CI)
- PSA 40.46000
- LogP 5.40200
4,4′-(1,2-Diethylethylene)di-o-cresol Chemical Properties
Molecular Structure of 4,4′-(1,2-Diethylethylene)di-o-cresol (CAS NO. 10465-10-8):
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IUPAC Name: 4-[(3S,4R)-4-(4-hydroxy-3-methylphenyl)hexan-3-yl]-2-methylphenol
Empirical Formula: C20H26O2
Molecular Weight: 298.4192
H bond acceptors: 2
H bond donors: 2
Freely Rotating Bonds: 7
Index of Refraction: 1.573
Molar Refractivity: 92.23 cm3
Molar Volume: 279.8 cm3
Surface Tension: 43.2 dyne/cm
Density: 1.066 g/cm3
Flash Point: 185.9 °C
Enthalpy of Vaporization: 69.86 kJ/mol
Boiling Point: 418.9 °C at 760 mmHg
Vapour Pressure: 1.3E-07 mmHg at 25°C
Index of Refraction: 1.573
InChI
InChI=1/C20H26O2/c1-5-17(15-7-9-19(21)13(3)11-15)18(6-2)16-8-10-20(22)14(4)12-16/h7-12,17-18,21-22H,5-6H2,1-4H3/t17-,18+
Smiles
c1(ccc(c(c1)C)O)[C@@H]([C@H](CC)c1ccc(c(c1)C)O)CC
Classification Code: Reproductive Effect
4,4′-(1,2-Diethylethylene)di-o-cresol Safety Profile
Experimental reproductive effects. When heated to decomposition it emits acrid smoke and irritating fumes.
4,4′-(1,2-Diethylethylene)di-o-cresol Specification
4,4′-(1,2-Diethylethylene)di-o-cresol ,with CAS number of 10465-10-8,can be called o-Cresol, 4,4'-(1,2-diethylethylene)di- ; meso-3,4-Bis(4-hydroxy-3-methylphenyl)hexane ; o-Cresol, 4,4'-(1,2-diethylethylene)di- ; 3-06-00-05541 (Beilstein Handbook Reference) [Beilstein] .
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