기본 정보
- 표준 SMILES
CCC(C)[O-].CCC(C)[O-].CCC(C)[O-].[Al+3]- InChIKey
WOZZOSDBXABUFO-UHFFFAOYSA-N- 분자식
- C12H27AlO3
- 평균 분자량
- 246.32 g/mol
- 단동위원소 질량
- 246.17755835
개요
Aluminum butylate is a chemical compound of aluminum. Aluminum is the most abundant metal in the earth's crust and is always found combined with other elements such as oxygen, silicon, and fluorine. (L739, L740)
이름 및 식별자
- 우선 이름
- Aluminum sec-butoxide
- IUPAC
- aluminum tris(butan-2-olate)
- 현지명
- 알루미늄 트리 sec-부톡사이드
- 영어명
- Aluminium tri-sec-butoxide
- 분자식
- C4H13AlO
- 분자량
- 104.13
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
2269-22-9- PubChem CID
- 61289
- DTXSID
DTXSID3044386- UNII
- FE7IK35OPN
물성
구조 계산 물성
- 극성 표면적
- 69.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 19.6
물리화학적 성질
- 끓는 점
- 40 °C · 40 °C
- 밀도
- 0.967 g/mL · 0.967 g/mL at 25 °C(lit.)
- 증기압
- 23 hPa · 23 hPa (195 °C)
- 굴절률
- 1.439 · 1.4390
- 인화점
- 82 °F · 82 °F
- 저장 조건
- 30 °C · Store below +30°C.
- 용해도
- 알코올, 이소프로필 알코올 및 톨루엔과 혼합 가능합니다.
- 물리적 상태
- 기름진 액체
- 색상
- 연노랑
- Specific Gravity
- 0.9671 · 0.9671
- 폭발한계
- 1.7 · 1.7-9.8%(V)
- 수용성
- 물에서 분해되다
- BRN
- 3910908 · 3910908
- 안정성
- 안정성 안정적이지만 공기와 습기에 노출되면 분해될 수 있습니다. 가연성. 강한 산화제, 강산, 물과 호환되지 않습니다.
- 화장품 원료 기능
- 광안정기
- InChI
- 1S/3C4H9O.Al/c3*1-3-4(2)5;/h3*4H,3H2,1-2H3;/q3*-1;+3
- InChIKey
- WOZZOSDBXABUFO-UHFFFAOYSA-N
- SMILES
- CCC(C)O[Al](OC(C)CC)OC(C)CC
- NIST
- Aluminum tri-sec-butoxide(2269-22-9)
- EPA
- 2 · 2-Butanol, aluminum salt (2269-22-9)
화학적 성질
viscous colourless or pale yellow liquid
안전 및 규제
안전 및 보호
독성 정보
Health Effects
Aluminum targets the nervous system and causes decreased nervous system performance and is associated with altered function of the blood-brain barrier. The accumulation of aluminum in the body may cause bone or brain diseases. High levels of aluminum have been linked to Alzheimer's disease. A small percentage of people are allergic to aluminium and experience contact dermatitis, digestive disorders, vomiting or other symptoms upon contact or ingestion of products containing aluminium. (L739, L740)
Toxicity Summary
The main target organs of aluminum are the central nervous system and bone. Aluminum binds with dietary phosphorus and impairs gastrointestinal absorption of phosphorus. The decreased phosphate body burden results in osteomalacia (softening of the bones due to defective bone mineralization) and rickets. Aluminum's neurotoxicity is believed to involve several mechanisms. Changes in cytoskeletal protein functions as a results of altered phosphorylation, proteolysis, transport, and synthesis are believed to be one cause. Aluminum may induce neurobehavioral effects by affecting permeability of the blood-brain barrier, cholinergic activity, signal transduction pathways, lipid peroxidation, and impair neuronal glutamate nitric oxide-cyclic GMP pathway, as well as interfere with metabolism of essential trace elements because of similar coordination chemistries and consequent competitive interactions. It has been suggested that aluminum's interaction with estrogen receptors increases the expression of estrogen-related genes and thereby contributes to the progression of breast cancer (A235), but studies have not been able to establish a clear link between aluminum and increased risk of breast cancer (A15468). Certain aluminum salts induce immune responses by activating inflammasomes. (L739, A235, A236)
Signs and Symptoms
Inhalating aluminum dust causes coughing and abnormal chest X-rays. A small percentage of people are allergic to aluminium and experience contact dermatitis, digestive disorders, vomiting or other symptoms upon contact or ingestion of products containing aluminium. (L739, L740)
Carcinogen Classification
Not listed by IARC. IARC classified aluminum production as carcinogenic to humans (Group 1), but did not implicate aluminum itself as a human carcinogen. (L135) A link between use of aluminum-containing antiperspirants and increased risk of breast cancer has been proposed (A235), but studies have not been able to establish a clear link (A15468).
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1992 3/PG 3
- 독성
- LD50 orally in Rabbit: 401 mg/kg LD50 dermal Rabbit 402 mg/kg
- HS 번호
- 29051900
- risk_code
- 40-21/22-10
- hazard_code
- Xn,Xi
- safety_code
- 36/37-45-43-36/37/39-26-16
- 포장분류
- III
- 위험 등급
- 3
- 기존화학 물질
- KE-03873
- F 고인화성물질
- 3-10-23
- 자연 발화 온도
- 763 °F
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 4 OralFlam. Liq. 3
- 스토리지 클래스
- 3 - Flammable liquids
화학 및 산업
약리 정보
Metabolism/Metabolites
Aluminum is poorly absorbed following either oral or inhalation exposure and is essentially not absorbed dermally. The bioavailability of aluminum is strongly influenced by the aluminum compound and the presence of dietary constituents which can complex with aluminum and enhance or inhibit its absorption. Aluminum binds to various ligands in the blood and distributes to every organ, with highest concentrations found in bone and lung tissues. In living organisms, aluminum is believed to exist in four different forms: as free ions, as low-molecular-weight complexes, as physically bound macromolecular complexes, and as covalently bound macromolecular complexes. Absorbed aluminum is excreted principally in the urine and, to a lesser extent, in the bile, while unabsorbed aluminum is excreted in the faeces. (L739)
응용 분야
용도It is used for active catalyst and support, inorganic membrane, redrcing agent of aldehyde-ketone, oxidant of aldehyde-ketone, gel forming agent of printing ink and paint, dehydrant, water proofing agent and aluminum base grease.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
관련 반응
연결된 노트
불러오는 중…