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26040-51-7 | 1,2-Benzenedicarboxylic acid, 3,4,5,6-tetrabromo-, 1,2-bis(2-ethylhexyl) ester
CAS No: 26040-51-7 Catalog No: AG002RHA MDL No:MFCD01941091
Product Description
Catalog Number:
AG002RHA
Chemical Name:
1,2-Benzenedicarboxylic acid, 3,4,5,6-tetrabromo-, 1,2-bis(2-ethylhexyl) ester
CAS Number:
26040-51-7
Molecular Formula:
C24H34Br4O4
Molecular Weight:
706.1404
MDL Number:
MFCD01941091
IUPAC Name:
bis(2-ethylhexyl) 3,4,5,6-tetrabromobenzene-1,2-dicarboxylate
InChI:
InChI=1S/C24H34Br4O4/c1-5-9-11-15(7-3)13-31-23(29)17-18(20(26)22(28)21(27)19(17)25)24(30)32-14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3
InChI Key:
UUEDINPOVKWVAZ-UHFFFAOYSA-N
SMILES:
CCCCC(COC(=O)c1c(C(=O)OCC(CCCC)CC)c(Br)c(c(c1Br)Br)Br)CC
Properties
Complexity:
514
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
705.915g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
706.148g/mol
Monoisotopic Mass:
701.919g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
10.6
Literature
| Title | Journal |
|---|---|
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| Analysis of common and emerging brominated flame retardants in house dust using ultrasonic assisted solvent extraction and on-line sample preparation via column switching with liquid chromatography-mass spectrometry. | Journal of chromatography. A 20120608 |
| Brominated flame retardants and dechlorane plus in the marine atmosphere from Southeast Asia toward Antarctica. | Environmental science & technology 20120320 |
| Atmospheric concentrations of halogenated flame retardants at two remote locations: the Canadian High Arctic and the Tibetan Plateau. | Environmental pollution (Barking, Essex : 1987) 20120201 |
| 2-Ethylhexyl tetrabromobenzoate and bis(2-ethylhexyl) tetrabromophthalate flame retardants in the Great Lakes atmosphere. | Environmental science & technology 20120103 |
| In vitro and in ovo effects of four brominated flame retardants on toxicity and hepatic mRNA expression in chicken embryos. | Toxicology letters 20111110 |
| Polybrominated diphenyl ethers vs alternate brominated flame retardants and Dechloranes from East Asia to the Arctic. | Environmental science & technology 20110815 |
| Analytical characteristics and determination of major novel brominated flame retardants (NBFRs) in indoor dust. | Analytical and bioanalytical chemistry 20110701 |
| 'Novel' brominated flame retardants in Belgian and UK indoor dust: implications for human exposure. | Chemosphere 20110501 |
| Brominated and chlorinated flame retardants: the San Antonio Statement. | Environmental health perspectives 20101201 |
| Flame-retardants and other organohalogens detected in sewage sludge by electron capture negative ion mass spectrometry. | Environmental science & technology 20100615 |
| Comment on 'Photodegradation pathways of nonabrominated diphenyl ethers, 2-ethylhexyltetrabromobenzoate and di(2-ethylhexyl)tetrabromophthalate: identifying potential markers of photodegradation'. | Environmental science & technology 20091015 |
| Temporal trends of hexabromocyclododecanes (HBCDs) and polybrominated diphenyl ethers (PBDEs) and detection of two novel flame retardants in marine mammals from Hong Kong, South China. | Environmental science & technology 20090915 |
| Photodegradation pathways of nonabrominated diphenyl ethers, 2-ethylhexyltetrabromobenzoate and di(2-ethylhexyl)tetrabromophthalate: identifying potential markers of photodegradation. | Environmental science & technology 20090801 |
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