기본 정보
- 표준 SMILES
O=S(Br)Br- InChIKey
HFRXJVQOXRXOPP-UHFFFAOYSA-N- 분자식
- Br2OS
- 평균 분자량
- 207.87 g/mol
- 단동위원소 질량
- 205.80365982
개요
Thionyl bromide is a chemical compound of bromine. Bromine is a halogen element with the symbol Br and atomic number 35. Diatomic bromine does not occur naturally, but bromine salts can be found in crustal rock. (L625)
이름 및 식별자
- 우선 이름
- Thionyl bromide
- IUPAC
- Sulfurous dibromide
- 영어명
- Thionyl bromide
- 분자식
- Br2OS
- 분자량
- 207.87
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
507-16-4- PubChem CID
- 68176
- DTXSID
DTXSID0060143- UNII
- N6CU78B13T
- EC Number
- 208-064-3
- Nikkaji
- J2.613A
물성
구조 계산 물성
- XLogP
- 1.6
- 극성 표면적
- 36.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 4
- 형식 전하
- 0
- 복잡도
- 29
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- -52 °C · -52 °C (lit.)
- 끓는 점
- 48 °C/20 · 48 °C/20 mmHg (lit.)
- 밀도
- 2.683 g/mL · 2.683 g/mL at 25 °C (lit.)
- 증기압
- 10 mm · 10 mm Hg ( 31 °C)
- 굴절률
- 20 · n20/D 1.675(lit.)
- 인화점
- 156 °C · 156°C
- 저장 조건
- 2 · 2-8°C
- 용해도
- 벤젠, 톨루엔, 에테르와 혼합 가능.
- 물리적 상태
- 노란색 액체
- Specific Gravity
- 2.683 · 2.683
- 색상
- 노란색 액체
- 수용성
- 2 O에 · H2O에 의해 가수분해되고; 벤젠, 클로로포름, CCl4 [MER06]와 혼화성
- Merck
- 14 · 14,9347
- Dielectric constant
- 13 · 13.0(20℃)
- InChI
- 1S/Br2OS/c1-4(2)3
- InChIKey
- HFRXJVQOXRXOPP-UHFFFAOYSA-N
- SMILES
- BrS(Br)=O
- NIST
- Thionyl bromide(507-16-4)
- EPA
- Thionyl bromide (507-16-4)
화학적 성질
Orange-yellow liquid. On prolonged standing, slowly decomposes into SO2, Br2 and S2Br2 and turns reddish; very sensitive to moisture. M.p. -49.5°C. Its thermal stability is poor and therefore SOBr2 can be distilled only in vacuum.
안전 및 규제
GHS 분류
GHS Classification
Danger
H312 (90.7%): Harmful in contact with skin [Warning Acute toxicity, dermal]
P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazards Summary
Hydrolyzed by water; A severe skin, eye, mucous membrane, and respiratory tract irritant; [Merck Index] Reacts violently with water; Causes burns and lachrymation; Inhalation may cause corrosive injuries to upper respiratory tract and pulmonary edema; [Alfa Aesar MSDS] See Thionyl fluoride and Thionyl chloride.
독성 정보
Treatment
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 Effects
Bromine vapour causes irritation and direct damage to the mucous membranes. Elemental bromine also burns the skin. The bromide ion is a central nervous system depressant and chronic exposure produces neuronal effects. This is called bromism and can result in central reactions reaching from somnolence to coma, cachexia, exicosis, loss of reflexes or pathologic reflexes, clonic seizures, tremor, ataxia, loss of neural sensitivity, paresis, papillar edema of the eyes, abnormal speech, cerebral edema, delirium, aggressiveness, and psychoses. (L625, L626, L627)
Toxicity Summary
Bromine is a powerful oxidizing agent and is able to release oxygen free radicals from the water in mucous membranes. These free radicals are also potent oxidizers and produce tissue damage. In additon, the formation of hydrobromic and bromic acids will result in secondary irritation. The bromide ion is also known to affect the central nervous system, causing bromism. This is believed to be a result of bromide ions substituting for chloride ions in the in actions of neurotransmitters and transport systems, thus affecting numerous synaptic processes. (L626, L627, A543)
Signs and Symptoms
Bromine vapour causes irritation and direct damage to the mucous membranes. Symptoms include lacrimation, rhinorrhoea, eye irritation with mucous secretions from the oropharyngeal and upper airways, coughing, dyspnoea, choking, wheezing, epistaxis, and headache. The bromide ion is a central nervous system depressant producing ataxia, slurred speech, tremor, nausea, vomiting, lethargy, dizziness, visual disturbances, unsteadiness, headaches, impaired memory and concentration, disorientation and hallucinations. This is called bromism. (L626, L627)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3264 8/PG 1
- risk_code
- 14-20/21-34
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- 포장분류
- II
- 위험 등급
- 8
- F 고인화성물질
- 8
- Hazard Classifications
- Acute Tox. 4 DermalSkin Corr. 1B
- 스토리지 클래스
- 8A - Combustible corrosive hazardous materials
화학 및 산업
약리 정보
Metabolism/Metabolites
Bromine is mainly absorbed via inhalation, but may also enter the body through dermal contact. Bromine salts can be ingested. Due to its reactivity, bromine quickly forms bromide and may be deposited in the tissues, displacing other halogens. (L626)
용도 및 제조
응용 분야
용도Thionyl Bromide is used in the preparation of carbon nanotube-phosphorylcholine polymer composite used in blood condition.
제조 방법
Reaction of SO2 with Br2 in the presence of PCl3: 64 g. of SO2 is added to a mixture of 138 g. of PCl3 and 160 g. of Br2 , while the reactor is cooled. The yield, after fractional distillation, is 180 g. of SOBr2.
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