Benzeneselenol

HCID 178757378CAS 244047-83-4

기본 정보

표준 SMILES
[SeH]c1ccccc1
InChIKey
WDODWFPDZYSKIA-UHFFFAOYSA-N
분자식
C6H6Se
평균 분자량
157.08 g/mol

개요

Benzeneselenol is a chemical compound of selenium. It is a useful reagent in organic synthesis. Selenium is a nonmetal element with the atomic number 34 and the chemical symbol Se. Selenium rarely occurs in its elemental state in nature and is usually found in sulfide ores such as pyrite, partially replacing the sulfur in the ore matrix. It may also be found in silver, copper, lead, and nickel minerals. Though selenium salts are toxic in large amounts, trace amounts of the element are necessary for cellular function in most animals, forming the active center of the enzymes glutathione peroxidase, thioredoxin reductase, and three known deiodinase enzymes. (L620, L622)

이름 및 식별자

우선 이름
Benzeneselenol
IUPAC
benzeneselenol
영어명
4-Hydroxy-1-hydroseleno-benzol4-Hydroxy-1-hydroseleno-benzol
분자식
C6H6OSe
분자량
173.07

이름 및 동의어

RefChem:563680DTXCID60227110211-457-2645-96-5BenzeneselenolDTXSID30275709Selenophenol57880-10-1?PHENYLSELENOLC6H6SeSCHEMBL150726SCHEMBL237664
이름 더 보기
Phenol, 4-seleno-4-Hydroxy-1-hydroseleno-benzol4-Hydroxy-1-hydroseleno-benzol
SCHEMBL4265002SCHEMBL6048219NSC229609NSC-229609FB178739NS00126258A12723Q3298985

데이터베이스 식별자

CAS
244047-83-4

물성

구조 계산 물성

극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
0
무거운 원자 수
7

물리화학적 성질

녹는점
56 · 56-57 °C
끓는 점
322.1 · 322.1±25.0 °C(Predicted)
산도 계수 (pKa)
5.66 · 5.66±0.70(Predicted)

안전 및 규제

안전 및 보호

Minimum Risk LevelChronic Oral: 0.005 mg/kg/day (L134)

독성 정보

Health Effects · 1건

Chronic oral exposure to high concentrations of selenium compounds can produce a disease called selenosis. The major signs of selenosis are hair loss, nail brittleness, and neurological abnormalities (such as numbness and other odd sensations in the extremities). Animal studies have shown that selenium may also affect sperm production and the female reproductive cycle. (L619)

Exposure RoutesOral (L619) ; inhalation (L619) ; dermal (L619)
Toxicity Summary · 1건

Selenium readily substitutes for sulfur in biomolecules and in many biochemical reactions, especially when the concentration of selenium is high and the concentration of sulfur is low. Inactivation of the sulfhydryl enzymes necessary for oxidative reactions in cellular respiration, through effects on mitochondrial and microsomal electron transport, might contribute to acute selenium toxicity. Selenomethionine (a common organic selenium compound) also appears to randomly substitute for methionine in protein synthesis. This substitution may affect the structure and functionability of the protein, for example, by altering disulfide bridges. Inorganic forms of selenium appear to react with tissue thiols by redox catalysis, resulting in formation of reactive oxygen species and causing damage by oxidative stress. (L619)

Signs and Symptoms · 1건

Short-term oral exposure to high concentrations of selenium may cause nausea, vomiting, and diarrhea. Brief exposures to high levels of elemental selenium or selenium dioxide in air can result in respiratory tract irritation, bronchitis, difficulty breathing, and stomach pains. Longer-term exposure to either of these air-borne forms can cause respiratory irritation, bronchial spasms, and coughing. (L619)

Carcinogen Classification3, not classifiable as to its carcinogenicity to humans. (L135)

화학 및 산업

약리 정보

Metabolism/Metabolites · 1건

Selenium may be absorbed through inhalation and ingestion, while some selenium compounds may also be absorbed dermally. Once in the body, selenium is distributed mainly to the liver and kidney. Selenium is an essential micronutrient and is a component of glutathione peroxidase, iodothyronine 5'-deiodinases, and thioredoxin reductase. Organic selenium is first metabolized into inorganic selenium. Inorganic selenium is reduced stepwise to the intermediate hydrogen selenide, which is either incorporated into selenoproteins after being transformed to selenophosphate and selenocysteinyl tRNA or excreted into the urine after being transformed into methylated metabolites of selenide. Elemental selenium is also methylated before excretion. Selenium is primarily eliminated in the urine and feces, but certain selenium compounds may also be exhaled. (L619)

용도 및 제조

UsesBenzeneselenol is a useful reagent in organic synthesis. (L622)
General Manufacturing InformationBenzeneselenol: ACTIVE

공급사3 곳

上海昶衍化工科技有限公司021-20242659 18930833303 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
郑州艾克姆化工有限公司037163312495 13303845143 · [email protected]

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