CAS No.70331-94-1,(1,2-Dioxoethylene)bis(iminoethylene) bis(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	70331-94-1
Name:	(1,2-Dioxoethylene)bis(iminoethylene) bis(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate)

Formula:	C₄₀H₆₀N₂O₈
Molecular Weight:	696.91
Synonyms:	Benzenepropanoic acid,3,5-bis(1,1-dimethylethyl)-4-hydroxy-,1,1'-[(1,2-dioxo-1,2-ethanediyl)bis(imino-2,1-ethanediyl)] ester;2,2'-Oxamidobis[ethyl 3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate];2,2'-Oxamidodiethyl bis[3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate];N,N'-Bis(2-hydroxyethyl)oxamide bis[b-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate];Naugard XL 1;XL 1;Benzenepropanoicacid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-,(1,2-dioxo-1,2-ethanediyl)bis(imino-2,1-ethanediyl) ester (9CI);
EINECS:	274-572-7
Density:	1.105 g/cm³
Melting Point:	178 °C
Solubility:	1.5μg/L at 20℃
Appearance:	white powder
PSA:	151.26000
LogP:	6.95380

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Specification

The IUPAC name of Benzenepropanoic acid,3,5-bis(1,1-dimethylethyl)-4-hydroxy-,1,1'-[(1,2-dioxo-1,2-ethanediyl)bis(imino-2,1-ethanediyl)] ester is 2-[[2-[2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyloxy]ethylamino]-2-oxoacetyl]amino]ethyl 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoate. With the CAS registry number 70331-94-1, it is also named as (1,2-Dioxoethylene)bis(iminoethylene) bis(3-(3,5-di-tert-butyl-4-hydroxyphenyl)propionate). The product's categories are Industrial / Fine Chemicals; Organics. Besides, it is white powder. In addition, its molecular formula is C₄₀H₆₀N₂O₈ and molecular weight is 696.91. Furthermore, this chemical is used as stabilizing agent of polyolefin, polyurethane, ABS resin and other communication cable.

The other characteristics of Benzenepropanoic acid,3,5-bis(1,1-dimethylethyl)-4-hydroxy-,1,1'-[(1,2-dioxo-1,2-ethanediyl)bis(imino-2,1-ethanediyl)] ester can be summarized as: (1)EINECS: 274-572-7; (2)ACD/LogP: 8.69; (3)# of Rule of 5 Violations: 3; (4)ACD/LogD (pH 5.5): 8.69; (5)ACD/LogD (pH 7.4): 8.69; (6)ACD/BCF (pH 5.5): 1000000; (7)ACD/BCF (pH 7.4): 1000000; (8)ACD/KOC (pH 5.5): 1267777.63; (9)ACD/KOC (pH 7.4): 1267493.63; (10)H bond acceptors: 10; (11)H bond donors: 4; (12)Freely Rotating Bonds: 21; (13)Polar Surface Area: 111.68 Å²; (14)Index of Refraction: 1.529; (15)Molar Refractivity: 194.72 cm³; (16)Molar Volume: 630.4 cm³; (17)Polarizability: 77.19×10^-24cm³; (18)Surface Tension: 40.6 dyne/cm; (19)Density: 1.105 g/cm³.

People can use the following data to convert to the molecule structure.
(1)SMILES:O=C(OCCNC(=O)C(=O)NCCOC(=O)CCc1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C)CCc2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C
(2)InChI:InChI=1/C40H60N2O8/c1-37(2,3)27-21-25(22-28(33(27)45)38(4,5)6)13-15-31(43)49-19-17-41-35(47)36(48)42-18-20-50-32(44)16-14-26-23-29(39(7,8)9)34(46)30(24-26)40(10,11)12/h21-24,45-46H,13-20H2,1-12H3,(H,41,47)(H,42,48)
(3)InChIKey:OXWDLAHVJDUQJM-UHFFFAOYAF