3,4,5,6-テトラブロモ-o-キシレン

3,4,5,6-Tetrabromo-o-xylene

HCID 17771CAS 2810-69-7

部分構造検索類似構造を探す

基本情報

標準SMILES: Cc1c(C)c(Br)c(Br)c(Br)c1Br
InChIKey: WVJRAJZMOVQFEC-UHFFFAOYSA-N
分子式: C8H6Br4
平均分子量: 421.75 g/mol
単同位体質量: 417.72029859

概要

3,4,5,6-tetrabromo-o-xylene is an off-white solid. (NTP, 1992)

名称と識別子

優先名称: 3,4,5,6-Tetrabromo-o-xylene
IUPAC: 1,2,3,4-tetrabromo-5,6-dimethylbenzene
現地名: 3,4,5,6-テトラブロモ-o-キシレン
英語名: 3,4,5,6-TETRABROMO-O-XYLENE
分子式: C8H6Br4
分子量: 421.75

名称と別名

3,4,5,6-TETRABROMO-O-XYLENEBenzene, dimethyl-, tetrabromo deriv.O-TETRABROMOXYLENERefChem:485661TETRABROMODIMETHYLBENZENE3,4,5,6-tetrabromo-1,2-dimethylbenzene3,4,5,6-TETRABROMO-O-DIMETHYLBENZENE1,2,3,4-tetrabromo-5,6-dimethylbenzene2810-69-7Tetrabromo-o-xylene36059-21-9Benzene, 1,2,3,4-tetrabromo-5,6-dimethyl-

名称をさらに表示

3,4,5,6-テトラブロモ-o-キシレンo-Xylene, 3,4,5,6-tetrabromo-

Tetrabromo-ortho-xyleneXylene, tetrabromo derivativetetrabromoxyleneCCRIS 4868EINECS 252-851-41,2-Dimethyltetrabromobenzenetetrabrom-o-xylolNSC12002

データベース識別子

CAS: 2810-69-7、36059-21-9
PubChem CID: 17771
DTXSID: DTXSID701031116
EC Number: 252-851-4
Nikkaji: J406.560C

物性

構造計算による物性

XLogP: 5.4
極性表面積: 0 Å²
水素結合供与体数: 0
水素結合受容体数: 0
回転可能結合数: 0
重原子数: 12
形式電荷: 0
複雑度: 143

実験および物理化学的性質

SolubilityInsoluble (<1 mg/ml at 70 °F) (NTP, 1992)

Boiling Point705 to 707 °F at 760 mmHg (NTP, 1992)

Melting Point504 °F (NTP, 1992)

Physical Description3,4,5,6-tetrabromo-o-xylene is an off-white solid. (NTP, 1992)

物理化学的性質

融点: 262 °C · 262°C
沸点: 303.01 °C · 303.01°C (rough estimate)
比重(密度): 2.2654 · 2.2654 (rough estimate)
屈折率: 1.704 · 1.7040 (estimate)

安全と法規制

危険有害性情報

Fire HazardsThe flash point of this material has not been determined, but it is probably non-flammable. (NTP, 1992)

Reactive GroupAryl Halides

Reactivity Profile · 1 件

Simple aromatic halogenated organic compounds, such as 3,4,5,6-TETRABROMO-O-XYLENE, are very unreactive. Halogenated organics generally become less reactive as more of their hydrogen atoms are replaced with halogen atoms. Materials in this group may be incompatible with strong oxidizing and reducing agents. Also, they may be incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides.

Air and Water ReactionsInsoluble in water.

安全と保護具

Fire FightingFires associated with this material can be controlled with a dry chemical, carbon dioxide, foam or Halon extinguisher. (NTP, 1992)

First Aid · 1 件

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 件

SMALL SPILLS AND LEAKAGE: You should dampen the solid spill material with acetone, then transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the adsorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 件

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)