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2,4,4'-트라이클로로-1,1'-바이페닐

2,4,4'-Trichlorobiphenyl

HCID 23448
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
7012-37-5
표준 SMILES
Clc1ccc(-c2ccc(Cl)cc2Cl)cc1
InChIKey
BZTYNSQSZHARAZ-UHFFFAOYSA-N
분자식
C12H7Cl3
평균 분자량
257.5 g/mol
단동위원소 질량
255.961333

개요

2,4,4'-trichlorobiphenyl is a polychlorobiphenyl.

이름 및 식별자

우선 이름
2,4,4'-Trichlorobiphenyl
IUPAC
2,4-dichloro-1-(4-chlorophenyl)benzene
현지명
2,4,4'-트라이클로로-1,1'-바이페닐
영어명
2,4,4'-Trichlorobiphenyl
분자식
C12H7Cl3
분자량
257.54

이름 및 동의어

2,4,4'-TRICHLOROBIPHENYL7012-37-5Pcb 282,4,4'-Trichloro-1,1'-biphenyl1,1'-Biphenyl, 2,4,4'-trichloro-2,4-dichloro-1-(4-chlorophenyl)benzeneBiphenyl, 2,4,4'-trichloro-4,2',4'-TrichlorobiphenylPCB-28DTXSID2038310844ODP31Q0RefChem:53614
이름 더 보기
2,4,4'-트라이클로로-1,1'-바이페닐k28NO 28BZ NO 28PCB NO 282,4,4'-CB2,4,4'-PCB2,4,4´PCBCONGENER28
DTXCID0018310230-293-2Pcb281,1'-Biphenyl,2,4,4'-trichloro-PCB No. 282,4,4 inverted exclamation marka-Trichlorobiphenyl2,4,4'-TRICHLOROBIPHENYL (IUPAC N. 28) (purity)CB-28

데이터베이스 식별자

CAS
7012-37-5
PubChem CID
23448
DTXSID
DTXSID2038310
ChEBI
CHEBI:233161
UNII
844ODP31Q0

물성

구조 계산 물성

XLogP
5.6
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
1
무거운 원자 수
15
형식 전하
0
복잡도
199

실험 및 물리화학적 성질

PolymersPolychlorinated biphenyl
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP5.62
Endocrine DisruptorsPotential endocrine disrupting compound
Collision Cross Section · 3건

144.79 Ų [M]+ [CCS Type: TW; Buffer gas: N2; Ionization: GC-APCI+]

149 Ų [M]+ [CCS Type: TIMS, Method: calibration with PAHs]

149.2 Ų [M-Cl+O]-

물리화학적 성질

녹는점
206 · 206-207℃
끓는 점
334.36 °C · 334.36°C (rough estimate)
밀도
1.351 · 1.3510 (rough estimate)
굴절률
1.604 · 1.6040 (rough estimate)
인화점
100 °C · 100 °C
저장 조건
2 · 2-8°C
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨)
수용성
116 ug/L · 116ug/L(25℃)
BRN
1956846 · 1956846

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Warning

H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]

P260, P273, P319, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 54 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Hazard Traits - Carcinogenicity; Dermatotoxicity; Developmental Toxicity; Endocrine Toxicity; Hepatotoxicity and Digestive System Toxicity; Immunotoxicity; Neurotoxicity; Reproductive Toxicity

Directive 2002/32/EC

Substance: 2,4,4'-trichlorobiphenyl

Hazard Classes and CategoriesSTOT RE 2 (100%)

안전 및 보호

Minimum Risk LevelIntermediate Oral: 0.03 ug/kg/day (L134)

독성 정보

Treatment · 1건

There are no specific treatments for PCB poisoning, since it is not usually recognized until after substantial chronic exposure. Only preventing further exposure and treating the observed symptoms can be done. Acute inhalation can be treated by administering oxygen. (L4)

Health Effects · 1건

The most common health effects of PCBs are skin conditions such as chloracne and rashes. Chronic PCB exposure has also been shown to cause liver, stomach and kidney, damage, jaundice, edema, anemia, changes in the immune system, behavioral alterations, and impaired reproduction. (L4)

화학 및 산업

약리 정보

Metabolism/Metabolites · 1건

PCBs are absorbed via inhalation, oral, and dermal routes of exposure. They are trasported in the blood, often bound to albumin. Due to their lipophilic nature they tend to accumulate in lipid-rich tissues, such as the liver, adipose, and skin. Metabolism of PCBs is very slow and varies based on the degree and position of chlorination. PCBs are metabolized by the microsomal monooxygenase system catalyzed by cytochrome P-450 enzymes to polar metabolites that can undergo conjugation with glutathione and glucuronic acid. The major metabolites are hydroxylated products which are excreted in the bile and faeces. The slow metabolism of PCBs means they tend to accumulate in body tissues. (L4, T6)

용도 및 제조

Uses · 1건

PCBs were used as coolants and lubricants in transformers, capacitors, and other electrical devices (such as fluorescent lights and refridgerators) produced before 1977. PCBs may contaminate the air and water near hazardous waste sites. In addition, PCBs bioaccumulate in the environment and may be found in fish, meat, and dairy products. (L4)

상·하류 제품 정보

상류 원료

Borinic acid, B,B-bis(4-chlorophenyl)-(2,6-dichloro-3-iodophenyl)-trimethylsilane(2,6-dichlorophenyl)-trimethylsilane1-Bromo-2,4-dichlorobenzene2,4-디클로로벤젠디아조늄테트라플루오로보레이트

관련 반응

0건
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화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
EC Number
230-293-2
Nikkaji
J147.962H
Henry's Law Constant
3 · 3.0×10-2 mol/(m3Pa) at 25℃, Li et al. (2003)
EPA
2 · 2,4,4'-Trichlorobiphenyl (7012-37-5)
Exposure RoutesOral (L4) ; inhalation (L4) ; dermal (L4)
Toxicity Summary · 1건

The mechanism of action varies with the specific PCB. Dioxin-like PCBs bind to the aryl hydrocarbon receptor, which disrupts cell function by altering the transcription of genes, mainly be inducing the expression of hepatic Phase I and Phase II enzymes, especially of the cytochrome P450 family. Most of the toxic effects of PCBs are believed to be results of Ah receptor binding. Other PBCs are believed to interfere with calcium channels and/or change brain dopamine levels. PCBs can also cause endocrine disurption by altering the production of thyroid hormones and binding to estrogen receptors, which can stimulate the growth of certain cancer cells and produce other estrogenic effects, such as reproductive dysfunction. They will bioaccumulate by binding to receptor proteins such as uteroglobin. (A3, A4, A30, A66)

Signs and SymptomsChronic PCB exposure results in symptoms such as abdominal pain, nausea, vomiting, diarrhea, headache, dizziness, depression, nervousness, dermal and ocular lesions, fatigue, irregular menstrual cycles and a lowered immune response. (A3)
Carcinogen Classification1, carcinogenic to humans. (L135)
Toxicity DataLD50: 1010 mg/kg (Oral, Rat) (T14) LD50: 880 mg/kg (Intraperitoneal, Mouse) (T14)

안전 데이터

wgk
3
rtecs
DV8840000
ridadr
2315
독성
TDLo orl-rat: 224 mg/kg (female 10í16D post):REP
risk_code
33-50/53-11-67-65-38
hazard_code
N,Xn,F
safety_code
35-60-61-62-33-29-16
포장분류
II
위험 등급
9
2,2',4,5,5'-펜타클로로-1,1'-바이페닐
2,2',5,5'-테트라클로로-1,1'-바이페닐
2,4-디클로로아닐린
2,3,3',4,4',5,6-Heptachlorobiphenyl
2,2',3,5'-테트라클로로바이페닐
2,2',3,4',5,5',6-Heptachlorobiphenyl

공급사41 곳

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