CAS No.123968-25-2,2-[1-(2-Hydroxy-3,5-di-tert-pentylphenyl)ethyl]-4,6-di-tert-pentylphenyl acrylate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	123968-25-2
Name:	2-[1-(2-Hydroxy-3,5-di-tert-pentylphenyl)ethyl]-4,6-di-tert-pentylphenyl acrylate

Formula:	C₃₇H₅₆O₃
Molecular Weight:	548.84
Synonyms:	2,2'-Ethylidenebis(4,6-di-tert-amylphenol) monoacrylate;KY 500;Sumilizer GS;Sumilizer GS(F);2-{1-[2-Hydroxy-3,5-bis(2-methyl-2-butanyl)phenyl]ethyl}-4,6-bis(2-methyl-2-butanyl)phenyl acrylate;
EINECS:	413-850-6
Density:	0.969 g/cm³
Boiling Point:	561.942 °C at 760 mmHg
Flash Point:	193.366 °C
Solubility:	5μg/L at 20℃
Risk Codes:	53
Safety:	61
PSA:	46.53000
LogP:	10.38580

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Specification

The 2-[1-(2-Hydroxy-3,5-di-tert-pentylphenyl)ethyl]-4,6-di-tert-pentylphenyl acrylate, with the CAS registry number 123968-25-2, is also known as 2,2'-Ethylidenebis(4,6-di-tert-amylphenol) monoacrylate. Its EINECS number is 413-850-6. This chemical's molecular formula is C₃₇H₅₆O₃ and molecular weight is 548.84. What's more, its systematic name is 2-{1-[2-Hydroxy-3,5-bis(2-methyl-2-butanyl)phenyl]ethyl}-4,6-bis(2-methyl-2-butanyl)phenyl acrylate. Its classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].

Physical properties of 2-[1-(2-Hydroxy-3,5-di-tert-pentylphenyl)ethyl]-4,6-di-tert-pentylphenyl acrylate are: (1)ACD/LogP: 12.419 # of Rule of 5 Violations: 2; (2)ACD/LogD (pH 5.5): 12.42; (3)ACD/LogD (pH 7.4): 12.42; (4)ACD/BCF (pH 5.5): 1000000.00; (5)ACD/BCF (pH 7.4): 1000000.00; (6)ACD/KOC (pH 5.5): 10000000.00; (7)ACD/KOC (pH 7.4): 10000000.00; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 14; (11)Polar Surface Area: 46.53 Å²; (12)Index of Refraction: 1.512; (13)Molar Refractivity: 169.864 cm³; (14)Molar Volume: 566.527 cm³; (15)Polarizability: 67.339×10^-24cm³; (16)Surface Tension: 32.57 dyne/cm; (17)Density: 0.969 g/cm³; (18)Flash Point: 193.366 °C; (19)Enthalpy of Vaporization: 87.637 kJ/mol; (20)Boiling Point: 561.942 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C/1/C=C\C(=O)\C=C\1C(C)(C)C
(2)Std. InChI: InChI=1S/C10H12O2/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6H,1-3H3
(3)Std. InChIKey: NCCTVAJNFXYWTM-UHFFFAOYSA-N