2,2',4'-Trichloroacetophenone

HCID 20250

기본 정보

CAS
4252-78-2
표준 SMILES
O=C(CCl)c1ccc(Cl)cc1Cl
InChIKey
VYWPPRLJNVHPEU-UHFFFAOYSA-N
분자식
C8H5Cl3O
평균 분자량
223.5 g/mol
단동위원소 질량
221.94059782

개요

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

이름 및 식별자

우선 이름
2,2',4'-Trichloroacetophenone
IUPAC
2-chloro-1-(2,4-dichlorophenyl)ethanone
영어명
2,2',4'-Trichloroacetophenone
분자식
C8H5Cl3O
분자량
223.48

이름 및 동의어

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
이름 더 보기
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

데이터베이스 식별자

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

물성

구조 계산 물성

XLogP
3.5
극성 표면적
17.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
2
무거운 원자 수
12

실험 및 물리화학적 성질

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

greater than 235 °F (NTP, 1992)

Flash Point > 235 °F

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

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

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

물리화학적 성질

녹는점
47 · 47-54 °C(lit.)
끓는 점
130 · 130-135 °C4 mm Hg(lit.)
밀도
1 · 1,312 g/cm3
굴절률
1.551 · 1.5510 (estimate)
인화점
230 °F · >230 °F
저장 조건
Keep in dark place,Sealed in dry,Room Temperature

화학적 성질

yellow crystalline powde

안전 및 규제

GHS 분류

GHS Classification · 4건

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.

유해성 정보

Regulatory Information · 2건

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 · 1건

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 · 1건

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

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

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 · 1건

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.

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk
3
ridadr
1759
HS 번호
29147090
risk_code
37/38-41-43-51/53-34-23/24/25
hazard_code
Xi,C,N,T
safety_code
26-36/37/39-61-45-37/39

화학 및 산업

응용 분야

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

일반 설명Off-white crystalline solid.

공급사100 곳

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]

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133건

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