Tris(2,3-dibromopropyl) isocyanurate - CAS 52434-90-9
Catalog: |
BB027827 |
Product Name: |
Tris(2,3-dibromopropyl) isocyanurate |
CAS: |
52434-90-9 |
Synonyms: |
1,3,5-tris(2,3-dibromopropyl)-1,3,5-triazinane-2,4,6-trione |
IUPAC Name: | 1,3,5-tris(2,3-dibromopropyl)-1,3,5-triazinane-2,4,6-trione |
Description: | Tris(2,3-dibromopropyl) isocyanurate (CAS# 52434-90-9) is a flame retardant that has applications in assessing potential bioaccumulation and impact on endocrine activity. It has been employed in flow-cytometric proliferation assay to determine potential estrogen-disruptive effects of flame retardants in MCF-7 cells. |
Molecular Weight: | 728.69 |
Molecular Formula: | C12H15Br6N3O3 |
Canonical SMILES: | C(C(CBr)Br)N1C(=O)N(C(=O)N(C1=O)CC(CBr)Br)CC(CBr)Br |
InChI: | InChI=1S/C12H15Br6N3O3/c13-1-7(16)4-19-10(22)20(5-8(17)2-14)12(24)21(11(19)23)6-9(18)3-15/h7-9H,1-6H2 |
InChI Key: | NZUPFZNVGSWLQC-UHFFFAOYSA-N |
Boiling Point: | 618.8 °C at 760 mmHg |
Melting Point: | 110 °C |
Purity: | 95 % |
Density: | 2.338 g/cm3 |
Appearance: | White powder |
MDL: | MFCD00010290 |
LogP: | 2.64690 |
GHS Hazard Statement: | H315 (98.44%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113338458-A | Flame-retardant EPS insulation board and preparation method thereof | 20210609 |
CN-113004838-A | Plugging material and preparation method and application thereof | 20210330 |
CN-112851178-A | Composite foaming agent and preparation method thereof | 20210226 |
CN-112812721-A | Curable epoxy resin composition | 20210208 |
CN-214175755-U | Environment-friendly fire-resistant flame-retardant cable | 20210202 |
PMID | Publication Date | Title | Journal |
26558450 | 20151201 | Tris-(2,3-dibromopropyl) isocyanurate induces depression-like behaviors and neurotoxicity by oxidative damage and cell apoptosis in vitro and in vivo | The Journal of toxicological sciences |
25042629 | 20150401 | Toxicity of new emerging pollutant tris-(2,3-dibromopropyl) isocyanurate on BALB/c mice | Journal of applied toxicology : JAT |
26458255 | 20150101 | Tris-(2,3-Dibromopropyl) Isocyanurate, a New Emerging Pollutant, Impairs Cognition and Provokes Depression-Like Behaviors in Adult Rats | PloS one |
24273086 | 20140301 | Use of an avian hepatocyte assay and the avian Toxchip Polymerse chain reaction array for testing prioritization of 16 organic flame retardants | Environmental toxicology and chemistry |
22663562 | 20120703 | Tris(2,3-dibromopropyl) isocyanurate, hexabromocyclododecanes, and polybrominated diphenyl ethers in mollusks from Chinese Bohai Sea | Environmental science & technology |
Complexity: | 392 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 728.61522 |
Formal Charge: | 0 |
Heavy Atom Count: | 24 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 722.62137 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 60.9 Å2 |
Undefined Atom Stereocenter Count: | 3 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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