ベンゾ[f]キノリン

Benzo(F)Quinoline

HCID 6796CAS 85-02-9

基本情報

標準SMILES
c1ccc2c(c1)ccc1ncccc12
InChIKey
HCAUQPZEWLULFJ-UHFFFAOYSA-N
分子式
C13H9N
平均分子量
179.22 g/mol
単同位体質量
179.07349929

概要

Benzo[f]quinoline appears as yellow crystals or white powder. Characteristic irritating odor. (NTP, 1992)

名称と識別子

優先名称
Benzo(F)Quinoline
IUPAC
benzo[f]quinoline
現地名
ベンゾ[f]キノリン
英語名
5,6-BENZOQUINOLINE
分子式
C13H9N
分子量
179.22

名称と別名

Benzo[f]quinoline5,6-BENZOQUINOLINE85-02-9Benzo(f)quinoline1-Azaphenanthrenebeta-Naphthoquinoline5,6-Benzo(f)quinolineDTXSID2024585NAPHTHOPYRIDINE525476DTMLDTXCID804585NSC-9850
名称をさらに表示
ベンゾ[f]キノリンナフトピリジンβ-ナフトキノリン5,6-ベンゾキノリンベンゾ(f)キノリン5,6-ベンゾキノリン標準品1-アザフェナントレン5,6‐ベンゾキノリン標準品5,6-ベンゾキノリン (50ΜG/ML トルエン溶液)BenzoquinolineNSC 9850b-naphthoquinoline5,6-naphthoquinoline,6-Benzo[f]quinoline
5,6-Benzo[f]quinolineRefChem:118233201-582-0.beta.-NaphthoquinolineBenzo(f)-quinolineazaphenanthreneMFCD00022235EINECS 201-582-0

データベース識別子

CAS
85-02-9
PubChem CID
6796
DTXSID
DTXSID2024585
ChEMBL
CHEMBL1565107
UNII
525476DTML
EC Number
201-582-0
Nikkaji
J4.907G

物性

構造計算による物性

XLogP
3.5
極性表面積
12.9 Ų
水素結合供与体数
0
水素結合受容体数
1
回転可能結合数
0
重原子数
14

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Quinolines
SpringerMaterials PropertiesAngular frequency
LogP3.25
Solubilityless than 0.1 mg/mL at 66 °F (NTP, 1992)
Flash Point330.8 °F (NTP, 1992)
Boiling Point662 °F at 721 mmHg (NTP, 1992)

物理化学的性質

融点
89 · 89-91 °C
沸点
349 °C · 349 °C (721 mmHg)
比重(密度)
1.1255 · 1.1255 (rough estimate)
屈折率
1.727 · 1.7270 (estimate)
闪点
166 °C · 166 °C
貯蔵温度
Keep in dark place,Sealed in dry,Room Temperature

化学的性質

化学的特性BROWN CRYSTALLINE POWDER

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H301 (97.5%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P264+P265, P270, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Not Classified

危険有害性情報

Regulatory InformationChemical: Benzo[f]quinoline
Fire HazardsThis compound is combustible. (NTP, 1992)
Health Hazards · 1 件

SYMPTOMS: Symptoms of exposure to this compound include severe local damage to the skin and mucous membranes indicated by discoloration, severe irritation, redness, swelling and the formation of blisters and bumps. It may also cause visual disturbances, eye irritation, conjunctivitis, light-sensitivity, tearing and burning sensations. Chronic exposure may cause necrosis and corneal injury.

Hazards Summary · 1 件

Causes severe irritation and local injury to skin and mucous membranes; Eye contact may cause severe visual disturbances, lachrymation, conjunctivitis, burning sensation, and corneal injury; [NTP] An irritant that may cause serious eye injury; Toxic by ingestion; [Sigma-Aldrich MSDS] See Quinoline and Naphthalene.

Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1 件

BENZO[F]QUINOLINE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. May generate hydrogen, a flammable gas, in combination with strong reducing agents such as hydrides.

安全と保護具

Fire FightingFires involving this compound should be controlled with a dry chemical, carbon dioxide 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: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE)MINIMUM PROTECTIVE CLOTHING: If Tyvek-type disposable protective clothing is not worn during handling of this chemical, wear disposable Tyvek-type sleeves taped to your gloves.

毒性情報

Adverse EffectsLacrimator (Lachrymator) - A substance that irritates the eyes and induces the flow of tears.

安全データ

rtecs
DK1428000
毒性
mma-sat 50 mg/plate 50NNAZ 7,73,83
hs_code
29334990
risk_code
40-36/37/38
安衛法
変異原性物質
hazard_code
Xn

化学と産業

用途と製造

UsesUsed as a reagent in the determination of cadmium; [Merck Index]
応用分野 · 3 件

用途カドミウムイオンの沈殿定量用試薬

使用As a reagent for the determination of cadmium which is pptd as (C13H9N)2H2(CdI4) from dil nitric or sulfuric acid solution in the presence of potassium iodide.

一般的な説明Yellow crystals or white powder. Characteristic irritating odor.

調製方法

純化方法Purify as 3,4-benzoquinoline above. The picrate has m 258.1-259o (from EtOH or H2O). [Albert et al. J Chem Soc 2240 1948, Beilstein 20 III/IV 4009, 20/8 V 220.]

サプライヤー50 社

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関連反応

7 件

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