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2,3,3',4,4'-펜타클로로바이페닐

Pcb 105

HCID 36188
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
32598-14-4
표준 SMILES
Clc1ccc(-c2ccc(Cl)c(Cl)c2Cl)cc1Cl
InChIKey
WIDHRBRBACOVOY-UHFFFAOYSA-N
분자식
C12H5Cl5
평균 분자량
326.4 g/mol
단동위원소 질량
323.883389

개요

2,3,4,3',4'-Pentachlorobiphenyl is a dichlorobenzene, a trichlorobenzene and a pentachlorobiphenyl.

이름 및 식별자

우선 이름
Pcb 105
IUPAC
1,2,3-trichloro-4-(3,4-dichlorophenyl)benzene
현지명
2,3,3',4,4'-펜타클로로바이페닐
영어명
2,3,3',4,4'-Pentachlorobiphenyl
분자식
C12H5Cl5
분자량
326.43

이름 및 동의어

2,3,3',4,4'-Pentachlorobiphenyl32598-14-4PCB 1051,2,3-trichloro-4-(3,4-dichlorophenyl)benzene2,3,4,3',4'-Pentachlorobiphenyl3,4,2',3',4'-PentachlorobiphenylPCB-1052,3,3',4,4'-PENTACHLORO-1,1'-BIPHENYL0S596V3MLHPCB1052,3,3'4,4'-Pentachloro-1,1'-biphenylDTXSID8038306
이름 더 보기
2,3,3',4,4'-펜타클로로바이페닐1,1'-Biphenyl, 2,3,3',4,4'-pentachloro-PenCbBZ NO 10523344PNCB23344PECBPCB NO 105C20010500 PCB No. 105Colesevelam Impurity 201,1'-BIPHENYL,2,3,3',4,4'-PEN
RefChem:535482,3,3',4,4'-PCBDTXCID6018306634-808-5PCB No. 105Biphenyl, 2,3,3',4,4'-pentachloro-2',3',4,4',5-PentachlorobiphenylCHEMBL341816

데이터베이스 식별자

CAS
32598-14-4
PubChem CID
36188

물성

구조 계산 물성

XLogP
6.6
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
1
무거운 원자 수
17
형식 전하
0
복잡도
259

실험 및 물리화학적 성질

PolymersPolychlorinated biphenyl
LogP6.61
Endocrine DisruptorsPotential endocrine disrupting compound
Collision Cross Section · 3건

161.1 Ų [M-Cl+O]-

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

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

물리화학적 성질

녹는점
116 · 116-117℃
끓는 점
412.3 °C · 412.3°C (rough estimate)
밀도
1.522 · 1.5220 (rough estimate)
굴절률
1.62 · 1.6200 (rough estimate)
용해도
클로로포름(약간 용해됨), 메탄올(약간 용해됨, 가열, 초음파 처리)
물리적 상태
고체
색상
흰색에서 황백색까지
Henry's Law Constant
3 · 3.0×10-2 mol/(m3Pa) at 25℃, Li et al. (2003)
EPA
2 · 2,3,3',4,4'-Pentachlorobiphenyl (32598-14-4)

안전 및 규제

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

GHS 분류

GHS Classification · 4건

Warning

H302 (92.9%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P270, P273, P301+P317, P319, P330, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Hazard Traits - Bioaccumulation; Carcinogenicity; Dermatotoxicity; Developmental Toxicity; Endocrine Toxicity; Environmental Persistence; Environmental tox; Hematotoxicity; Hepatotoxicity and Digestive System Toxicity; Immunotoxicity; Reproductive Toxicity; Respiratory Toxicity

Regulation (EC) No 178/2002 (amended)

Hazard Classes and CategoriesAcute Tox. 4 (92.9%)

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)

MeSH Pharmacological ClassificationSubstances or energies, for example heat or light, which when introduced into the air, water, or land threaten life or health of individuals or ECOSYSTEMS.

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)

응용 분야

용도2'',3'',4,4'',5-Pentachlorobiphenyl is a toxic organic pollutant.

상·하류 제품 정보

하류 제품

2,4,4'-트라이클로로-1,1'-바이페닐

공급사23 곳

관련 반응

0건
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화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
DTXSID
DTXSID8038306
ChEMBL
CHEMBL341816
ChEBI
CHEBI:81518
UNII
0S596V3MLH
EC Number
634-808-5
Nikkaji
J70.043F
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)
RAIS Toxicity Values · 6건

0.00114

WHO/TEF

0.00133333333333333

WHO/TEF

2.33333333333333e-05

WHO/TEF

Hazard Quotient Level 0.1 or Cancer Risk Level 1E-06 · 6건

1.20e-01

4.90e-01

2.50e-03

1.10e-02

4.00e-03

5.00e+02

Hazard Quotient Level 3 or Cancer Risk Level 1E-04 · 6건

4.10e+00

4.90e+01

2.50e-01

1.10e+00

4.00e-01

5.00e+02

안전 데이터

rtecs
DV8200000
ridadr
UN 3432 9/PG 2
독성
LD50 ipr-mus: 400 mg/kg CPBTAL 24,2168,76
risk_code
33-50/53
hazard_code
N
safety_code
35-60-61
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