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Ethyl 2-(3-tert-butyl-4-hydroxyphenoxy)tetradecanoate

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Name

Ethyl 2-(3-tert-butyl-4-hydroxyphenoxy)tetradecanoate

EINECS 250-887-5
CAS No. 31994-60-2 Density 0.978 g/cm3
PSA 55.76000 LogP 7.31120
Solubility N/A Melting Point N/A
Formula C26H44O4 Boiling Point 510.37 °C at 760 mmHg
Molecular Weight 420.633 Flash Point 156.736 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 31994-60-2 (Ethyl 2-(3-tert-butyl-4-hydroxyphenoxy)tetradecanoate) Hazard Symbols N/A
Synonyms

Tetradecanoicacid, 2-(3-tert-butyl-4-hydroxyphenoxy)-, ethyl ester (8CI);2-tert-Butyl-4-(a-carboethoxytridecyloxy)phenol;

 

Ethyl 2-(3-tert-butyl-4-hydroxyphenoxy)tetradecanoate Chemical Properties

IUPAC Name: Ethyl 2-(3-tert-butyl-4-hydroxyphenoxy)tetradecanoate
Synonyms of : Ethyl 2-(m-tert-butyl-p-hydroxyphenoxy)tetradecanoate
CAS NO: 31994-60-2
Molecular Formula: C26H44O4
Molecular Weight: 420.62
Molecular Structure:
EINECS: 250-887-5
H bond acceptors: 4
H bond donors: 1
Freely Rotating Bonds: 18
Polar Surface Area: 44.76 Å2
Index of Refraction: 1.49
Molar Refractivity: 124.42 cm3
Molar Volume: 430 cm3
Surface Tension: 34.9 dyne/cm
Density: 0.978 g/cm3
Flash Point: 156.7 °C
Enthalpy of Vaporization: 81.06 kJ/mol
Boiling Point: 510.4 °C at 760 mmHg
Vapour Pressure: 4.88E-11 mmHg at 25°C 
SMILES: O=C(OCC)C(Oc1ccc(O)c(c1)C(C)(C)C)CCCCCCCCCCCC
InChI: InChI=1/C26H44O4/c1-6-8-9-10-11-12-13-14-15-16-17-24(25(28)29-7-2)30-21-18-19-23(27)22(20-21)26(3,4)5/h18-20,24,27H,6-17H2,1-5H3
InChIKey: USQBFMHVASTQGU-UHFFFAOYAQ
Std. InChI: InChI=1S/C26H44O4/c1-6-8-9-10-11-12-13-14-15-16-17-24(25(28)29-7-2)30-21-18-19-23(27)22(20-21)26(3,4)5/h18-20,24,27H,6-17H2,1-5H3
Std. InChIKey: USQBFMHVASTQGU-UHFFFAOYSA-N

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