2,2',4'-トリクロロアセトフェノン

2,2',4'-Trichloroacetophenone

HCID 20250

基本情報

CAS
4252-78-2
標準SMILES
O=C(CCl)c1ccc(Cl)cc1Cl
InChIKey
VYWPPRLJNVHPEU-UHFFFAOYSA-N
分子式
C8H5Cl3O
平均分子量
223.5 g/mol
単同位体質量
221.94059782

概要

2,2',4'-trichloroacetophenone is an off-white crystalline solid. (NTP, 1992)

名称と識別子

優先名称
2,2',4'-Trichloroacetophenone
IUPAC
2-chloro-1-(2,4-dichlorophenyl)ethanone
現地名
2,2',4'-トリクロロアセトフェノン
英語名
2,2',4'-Trichloroacetophenone
分子式
C8H5Cl3O
分子量
223.48

名称と別名

2,2',4'-Trichloroacetophenone4252-78-22,4-Dichlorophenacyl chlorideEthanone, 2-chloro-1-(2,4-dichlorophenyl)-alpha,2,4-TrichloroacetophenoneDTXSID3026190Chloromethyl 2,4-dichlorophenyl ketone2E35P7HJI2DTXCID506190RefChem:80612224-218-22-Chloro-1-(2,4-dichlorophenyl)ethanone
名称をさらに表示
2,2',4'-トリクロロアセトフェノンω,2',4'-トリクロロアセトフェノン2',4'-ジクロロ-α-クロロアセトフェノン2,4-ジクロロフェナシルクロリド(トリクロロアセチル)ベンゼンα,2',4'-トリクロロアセトフェノンα,α,α-トリクロロアセトフェノン2,2',4'-トリクロロアセトンフェノン2,2′,4′-トリクロロアセトフェノン2-クロロ-1-(2,4-ジクロロフェニル)エタノン2,2′,4′‐トリクロロアセトフェノン塩化2,4-ジクロロフェナシル塩化2,4-ジクロロフェナシル, 97%2-クロロ-1-(2,4-ジクロロフェニル)エタン-1-オン1-(2,4-ジクロロフェニル)-2-クロロエタノンω,2′,4′-トリクロロアセトフェノン2′,4′-ジクロロ-α-クロロアセトフェノンα,2′,4′-トリクロロアセトフェノンTRICHLOROACETOPHENONE2,2′,4′-Trichloracetophenon2,2,4-TRICHLORO ACETOPHENONEalpha-2,4-Tric2,2',4'-TrichL2,2',4-TrichloroTRICHLOROACETOPHENONEconazole Impurity 11
2-chloro-1-(2,4-dichlorophenyl)ethan-1-oneMFCD00000934.alpha.,2,4-TrichloroacetophenoneNCGC00091258-01NCGC00091258-021-(2,4-dichlorophenyl)-2-chloroethan-1-one2,2 inverted exclamation marka,4 inverted exclamation marka-TrichloroacetophenoneCCRIS 633

データベース識別子

CAS
4252-78-2
PubChem CID
20250
DTXSID
DTXSID3026190
ChEMBL
CHEMBL1569226
UNII
2E35P7HJI2
EC Number
224-218-2
Nikkaji
J199F

物性

構造計算による物性

XLogP
3.5
極性表面積
17.1 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
2
重原子数
12

実験および物理化学的性質

Chemical ClassesOther Classes -> Aromatic Ketones, Halogenated
Solubilityless than 1 mg/mL at 68 °F (NTP, 1992)
Flash Point · 2 件

greater than 235 °F (NTP, 1992)

Flash Point > 235 °F

Melting Point126 to 131 °F (NTP, 1992)
Physical Description · 2 件

2,2',4'-trichloroacetophenone is an off-white crystalline solid. (NTP, 1992)

Off-white crystalline solid; [CAMEO] Melting point = 52-55 deg C; [MSDSonline]

物理化学的性質

融点
47 · 47-54 °C(lit.)
沸点
130 · 130-135 °C4 mm Hg(lit.)
比重(密度)
1 · 1,312 g/cm3
屈折率
1.551 · 1.5510 (estimate)
闪点
230 °F · >230 °F
貯蔵温度
Keep in dark place,Sealed in dry,Room Temperature

化学的性質

化学的特性yellow crystalline powde

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H301 (49.4%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 83 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 2 件

Status: Active Update: 02-10-2015 https://echa.europa.eu/registration-dossier/-/registered-dossier/16015

2,2',4'-Trichloroacetophenone: Does not have an individual approval but may be used under an appropriate group standard

DOT LabelCorrosive
Fire HazardsThis chemical is probably combustible. (NTP, 1992)
Health Hazards · 1 件

SYMPTOMS: Symptoms of exposure to this compound include corrosion and lachrymation. Inhalation may be fatal as a result of spasm, inflammation and edema of the larynx and bronchi, chemical pneumonitis and pulmonary edema. Other symptoms include burning sensation, coughing, wheezing, laryngitis, shortness of breath, headache, nausea and vomiting.

Hazards Summary · 1 件

A corrosive substance that can cause severe injury to the skin, eyes, mucous membranes and respiratory tract; A lachrymator; [CAMEO] Toxic if swallowed; An irritant; Causes burns; May cause chemical pneumonitis after inhalation of high concentrations; [MSDSonline]

Reactive GroupHalogenated Organic Compounds

安全と保護具

Fire FightingFires involving this material can 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.

Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Personal Protective Equipment (PPE)MINIMUM PROTECTIVE CLOTHING: If Tyvek protective clothing is not worn during the handling of this chemical, wear disposable Tyvek sleeves taped to your gloves.

毒性情報

Adverse EffectsDermatotoxin - Skin burns.

安全データ

wgk
3
ridadr
1759
hs_code
29147090
risk_code
37/38-41-43-51/53-34-23/24/25
hazard_code
Xi,C,N,T
hazard_note
Corrosive/Lachrymatory

化学と産業

応用分野 · 3 件

用途有機合成原料。

使用α,2,4-Trichloroacetophenone is a reagent used in the synthesis of isoconazole, a potent antifungal agent.

一般的な説明Off-white crystalline solid.

サプライヤー100 社

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Ark Pharm, Inc.847-367-3680 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]

関連反応

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