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2,6-Dichlorobiphenyl

HCID 36342
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
33146-45-1
Standard SMILES
Clc1cccc(Cl)c1-c1ccccc1
InChIKey
IYZWUWBAFUBNCH-UHFFFAOYSA-N
Molecular formula
C12H8Cl2
Average molar mass
223.09 g/mol
Monoisotopic mass
222.0003056

Overview

2,6-dichlorobiphenyl is a dichlorobiphenyl that is 1,3-dichlorobenzene in which the hydrogen at position 2 is replaced by a phenyl group. It is a dichlorobenzene and a dichlorobiphenyl.

Names & identifiers

Preferred name
2,6-Dichlorobiphenyl
IUPAC
1,3-dichloro-2-phenylbenzene
English name
2,6-Dichlorobiphenyl
Molecular formula
C12H8Cl2
Molecular weight
223.1

Names & synonyms

2,6-DICHLOROBIPHENYL2,6-Dichloro-1,1'-biphenyl33146-45-11,1'-Biphenyl, 2,6-dichloro-PCB 101,3-dichloro-2-phenylbenzene0S2FWS766GDTXSID7038313CHEBI:34249RefChem:53586DTXCID5018313690-138-3
Show more names
BZNO 10PCB NO 10C20001000 PCB No. 10biphenyl,2,6-dichloro-2,6-Dichlorobiphenyl-d5PCB No. 10 in Cyclohexane
Biphenyl, 2,6-dichloro-PCB No. 10UNII-0S2FWS766G2,6-Dicb2,6-Dichloro-1,1-biphenylSCHEMBL308199SCHEMBL533314SCHEMBL2752419

Database identifiers

CAS
33146-45-1
PubChem CID
36342
DTXSID
DTXSID7038313
ChEMBL
CHEMBL1232135
ChEBI
CHEBI:34249
UNII
0S2FWS766G
EC Number
690-138-3
Nikkaji
J88.845A

Properties

Computed structural properties

XLogP
5
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
165

Experimental & physicochemical properties

SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP4.93
Collision Cross Section140.3 Ų [M]+ [CCS Type: TIMS, Method: calibration with PAHs]

Physicochemical properties

Melting point
35.5 °C · 35.5°C
Boiling point
289.78 °C · 289.78°C (rough estimate)
Density
1.249 · 1.2490 (rough estimate)
refractive index
1.594 · 1.5940 (rough estimate)
Water Solubility
2.41 mg/L · 2.41mg/L(25 ºC)
Henry's Law Constant
1.2 · 1.2×10-2 mol/(m3Pa) at 25℃, Paasivirta and Sinkkonen (2009)
FDA UNII
0 S2FWS766G · 0S2FWS766G
EPA Substance Registry System
2 · 2,6-Dichlorobiphenyl (33146-45-1)
Symbol(GHS)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 7.1% (3 of 42) of reports.

Warning

H373 (92.9%): 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 42 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSTOT RE 2 (92.9%)

Safety & protection

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

Toxicology

Treatment · 1 item

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 · 1 item

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)

Exposure Routes

Chemistry & industry

Pharmacology

Metabolism/Metabolites · 1 item

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)

Uses & manufacturing

Uses · 1 item

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)

Applications

Uses2,6-Dichlorobiphenyl is a polychlorinated biphenyl (PCB) congeners.

Upstream & downstream products

Upstream raw materials

2,4-Dichlorobiphenyl2,4,6-Trichlorobiphenyl

Suppliers27 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Related reactions

1 records
New reaction record
HRID 1848952 reaction equation
HRID 1848952As productuspto-grants-2015_02

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
8 · GHS08,GHS09
Signal word
Warning
Hazard statements
373 · H373-H410
Precautionary statements
273 · P273-P391-P501-P260-P314-P501
Oral (L4) ; inhalation (L4) ; dermal (L4))
Toxicity Summary · 1 item

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)

Safety data

Signal word
Warning
Symbol(GHS)
GHS08,GHS09
Hazard statements
H373-H410
Precautionary statements
P273-P391-P501-P260-P314-P501
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
盐城通铭生物科技有限公司15195160625 · [email protected]
上海稳同科技有限公司02151600108 13062666369 · [email protected]
上海毕楷科技有限公司18516304666 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
上海耐士化工科技有限公司400-188-0725 +86 21 34310725 13611771617
常州康瑞医药科技有限公司+86-0519-85485169 +86-13961161173 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
天津阿尔塔科技有限公司022-65378550-8551 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
成都华纯科技有限公司400-1166-196 15982826727 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
上海臻励生物科技有限公司021-16621358918; 18516310516;16621358918;13045646768 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
广东翁江化学试剂有限公司0751-2815688 13927872512 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Aladdin Scientific[email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
Nanjing discovery pharma Technology Co., Ltd+86-18651673534 · [email protected]
青岛腾龙微波科技有限公司0532-83818797 17669478191 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
南京迪斯卡瑞医药科技有限公司18651673534微信同号 18651673534 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
南京世洲生物科技有限公司17301488900 · [email protected]

Additional notes

DefinitionChEBI: A dichlorobiphenyl that is 1,3-dichlorobenzene in which the hydrogen at position 2 is replaced by a phenyl group.