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3,3'-Dibromobiphenyl

HCID 153987
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Grundinformationen

CAS
16400-51-4
Standard-SMILES
Brc1cccc(-c2cccc(Br)c2)c1
InChIKey
LPLLWKZDMKTEMV-UHFFFAOYSA-N
Summenformel
C12H8Br2
Durchschnittliche Molmasse
312 g/mol
Monoisotopische Masse
309,89927446

Überblick

3,3'-Dibromobiphenyl is a polybrominated biphenyl. Polybrominated biphenyls (PBBs) are a group of 209 synthetic organic compounds with 1-10 bromine atoms attached to biphenyl. They can be used as flame retardants and may be added to the plastics used to make products like computer monitors, televisions, textiles, and plastic foams to make them difficult to burn. However, the use of PBBs is banned or restricted in most areas due to their toxicity and persistence in the environment. (L628, L629)

Namen und Bezeichner

Bevorzugter Name
3,3'-Dibromobiphenyl
IUPAC
1-bromo-3-(3-bromophenyl)benzene
Englischer Name
1-bromo-3-(3-bromophenyl)benzene
Summenformel
C12H8Br2
Molmasse
312

Namen und Synonyme

3,3'-Dibromo-1,1'-biphenyl3,3'-dibromobiphenyl1-bromo-3-(3-bromophenyl)benzene1,1'-Biphenyl, 3,3'-dibromo-UNII-4N7BB4740Z4N7BB4740ZPBB 11DTXSID50167692RefChem:90670DTXCID9090183803-115-116400-51-4
Weitere Namen anzeigen
3,3'-DBB1-broMo-3-(3-broMophm,m'-Dibromobiphenyl3,3'-Bibromo biphenylBiphenyl, 3,3'-dibromo-1,1'-Biphenyl,3,3'-dibroMo-
MFCD209267883,3'-DibromodiphenylSCHEMBL312091SCHEMBL5584568SCHEMBL6683909SCHEMBL8378576SCHEMBL15066583SCHEMBL29546450

Datenbank-Bezeichner

CAS
16400-51-4
PubChem CID
153987
DTXSID
DTXSID50167692
UNII
4N7BB4740Z
EC Number
803-115-1
Nikkaji
J82.503D

Eigenschaften

Berechnete StruktureigenschaftenWird ergänzt

XLogP
4,9
Polarare Oberfläche (TPSA)
0 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
0
Frei drehbare Bindungen
1
Schwere Atome
14
Formalladung
0
Komplexität
161

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesSchoenflies notation

Physikochemische Eigenschaften

Schmelzpunkt
171 °C · 171 °C
Siedepunkt
338.6 · 338.6±17.0 °C(Predicted)
Dichte
1.667 · 1.667
storage temp.
Sealed in dry,Room Temperature
InChI
InChI=1S/C12H8Br2/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8H
InChIKey
LPLLWKZDMKTEMV-UHFFFAOYSA-N
SMILES
C1(C2=CC=CC(Br)=C2)=CC=CC(Br)=C1

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Sicherheit und Schutzausrüstung

Minimum Risk LevelAcute Oral: 0.01 mg/kg/day (L134)

Toxikologische Informationen

Treatment · 1 Eintrag

EYES: irrigate opened eyes for several minutes under running water. INGESTION: do not induce vomiting. Rinse mouth with water (never give anything by mouth to an unconscious person). Seek immediate medical advice. SKIN: should be treated immediately by rinsing the affected parts in cold running water for at least 15 minutes, followed by thorough washing with soap and water. If necessary, the person should shower and change contaminated clothing and shoes, and then must seek medical attention. INHALATION: supply fresh air. If required provide artificial respiration.

Health EffectsPBB exposure may cause weight loss, skin disorders (such as acne), nervous and immune systems effects, and effects on the liver, kidneys, and thyroid gland. (L628)
Exposure RoutesOral (L628) ; inhalation (L628) ; dermal (L628)
Toxicity Summary · 1 Eintrag

The exact mechanism of toxicty of PBBs varies depending on the specific congener. The predominant interaction is believed to involve the aryl hydrocarbon receptor (AhR). PBBs bind to and activate the AhR, which in turn initiates the transcriptional upregulation of a number of genes, affecting biochemical and endocrine pathways, cell cycle regulation, morphogenesis, oxidative stress response, and various other processes. This results in the numerous toxic responses characteristic of PBBs. Some of the known induced genes include the cytochrome P-450-dependent monooxygenases CYP1A1 and CYP1A2. (L628)

Signs and SymptomsSymptoms of PBB exposure may include nausea, abdominal pain, loss of appetite, joint pain, fatigue, and weakness. (L629)
Carcinogen Classification2A, probably carcinogenic to humans. (L135)

Sicherheitsdaten

hs_code
2903998090

Chemie und Industrie

Pharmakologische Informationen

Metabolism/Metabolites · 1 Eintrag

PBBs can be absorbed via oral, inhalation, and dermal routes. Due to their lipophilic nature, PBBs, especially the highly brominated congeners, tend to accumulate in lipid-rich tissues such as the liver, adipose, skin, and breast milk. Certain PBB compounds are metabolized by the microsomal monooxygenase system catalyzed by cytochrome P-450 of the type induced by phenobarbital. The rate of metabolism may depends on the bromine substitution pattern. PBB congeners of low bromine content are transformed into hydroxylated derivatives that are predominately eliminated in the urine. Highly brominated congeners are either retained or excreted unchanged in the feces. (L628)

Verwendung und Herstellung

Uses · 1 Eintrag

PBBs can be used as flame retardants and may be added to the plastics used to make products like computer monitors, televisions, textiles, and plastic foams to make them difficult to burn. However, the use of PBBs is banned or restricted in most areas due to their toxicity and persistence in the environment. (L628, L629)

Vor- und nachgelagerte Produkte

Nachgelagerte Produkte

1,6-Dibromopyrene2-Iodmesitylen

Anbieter100 Anbieter

郑州阿尔法化工有限公司+86-18530059196 · [email protected]
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陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
BAYNOE CHEM CO.,LTD+86-21-34783353 +8615000719740 · [email protected]
河南多贝化工有限公司0370-6999054 17550096163 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
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北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
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安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
石家庄斯迪亚诺精细化工有限公司0311-89250318 13582355795 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
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江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
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北京京土恒盛化工科技有限公司00-13911456598 13911456598 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海洽凡生化科技有限公司+86-021-61654350 · [email protected]
安徽科诺精细化工有限公司0550-0550-7097550 15051613561 · [email protected]
上海孚一生物科技有限公司+86 (21) 61124340
池州凯隆进出口贸易有限公司[email protected]
郑州海阔光电材料有限公司86-0371-67759225 13526468238 · [email protected]
杭州鼎燕化工有限公司0571-87157530-8003 18049756717 · [email protected]
北京建强伟业科技有限公司(FUSION弗珍试剂品牌)0531-88924771 15614660963 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
康幸生物科技(上海)有限公司021-61556450 15800904410
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南京艾比克斯生化科技有限公司025-87193546 18652950785 · [email protected]
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上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
Yurui (Shanghai) Chemical Co., Ltd.+86-021-50456736 +8613331628239;+8619121032725 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
郑州安慕斯化工产品有限公司15981811963 18737195735 · [email protected]
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JACS-郑州杰克斯化工产品有限公司0371-0371-86259281 15981966935 · [email protected]

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