기본 정보
- CAS
594-82-1- 표준 SMILES
CC(C)(C)C(C)(C)C- InChIKey
OMMLUKLXGSRPHK-UHFFFAOYSA-N- 분자식
- C8H18
- 평균 분자량
- 114.23 g/mol
- 단동위원소 질량
- 114.14085057
개요
2,2,3-Trimethylpentane is a hydrocarbon and one of the isomers of octane. Octanes may be found in gasoline. (L1296)
이름 및 식별자
- 우선 이름
- 2,2,3,3-Tetramethylbutane
- IUPAC
- 2,2,3,3-tetramethylbutane
- 영어명
- 2,2,3,3-Tetramethylbutane
- 분자식
- C8H18
- 분자량
- 114.23
이름 및 동의어
2,2,3,3-TETRAMETHYLBUTANEHexamethylethaneTetramethylbutaneButane, 2,2,3,3-tetramethyl-UNII-EB34RI15NYEB34RI15NYNSC 62039EINECS 209-855-6NSC-62039DTXSID9073204(CH3)3CC(CH3)3Ethane, hexamethyl
이름 더 보기
RefChem:80827Butane, 2,2,3,3tetramethylDTXCID4042624UN1325Butane, 2,2,3,3-tetramethyl-(8CI)Butane, 2,2,3,3-tetramethyl-(8CI)(9CI)209-855-6InChI=1/C8H18/c1-7(2,3)8(4,5)6/h1-6H
데이터베이스 식별자
- CAS
594-82-1- PubChem CID
- 11675
- DTXSID
DTXSID9073204- UNII
- EB34RI15NY
- EC Number
- 209-855-6
- Nikkaji
- J44.108B
물성
구조 계산 물성
- XLogP
- 3.7
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 8
- 형식 전하
- 0
- 복잡도
- 55
실험 및 물리화학적 성질
SolventsSolvents -> Aliphatics, Saturated (<C12)
SpringerMaterials PropertiesSchoenflies notation
Vapor Pressure20.9 [mmHg]
Physical DescriptionNearly white solid; [Sigma-Aldrich MSDS]
물리화학적 성질
- 녹는점
- 100.7 °C · 100.7 °C
- 끓는 점
- 106.4 °C · 106.4 °C
- 밀도
- 0.823 g/cm3 · 0.823 g/cm3(Temp: 23 °C)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H225: Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P271, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P319, P321, P331, P332+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Danger
H228 (95.1%): Flammable solid [Danger Flammable solids]
P210, P240, P241, P261, P264, P271, P273, P280, P301+P316, P302+P352, P304+P340, P319, P321, P331, P332+P317, P362+P364, P370+P378, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
유해성 정보
Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS]
Hazard Classes and Categories
Flam. Sol. 1 (95.1%)
Flammable liquid - category 2
Flam. Liq. 2
독성 정보
Treatment
Treatment is mainly symptomatic and supportive. Gastric lavage, emesis, and the administration of activated charcoal should be avoided, as vomiting increases the risk of aspiration. (A600)
Treatment is mainly symptomatic and supportive. Gastric lavage, emesis, and the administration of activated charcoal should be avoided, as vomiting increases the risk of aspiration. (A600)
Health Effects
Petroleum distillates are aspiration hazards and may cause pulmonary damage, central nervous system depression, and cardiac effects such as cardiac arrhythmias. They may also affect the blood, immune system, liver, and kidney. (A600, L1297)
Petroleum distillates are aspiration hazards and may cause pulmonary damage, central nervous system depression, and cardiac effects such as cardiac arrhythmias. They may also affect the blood, immune system, liver, and kidney. (A600, L1297)
화학 및 산업
약리 정보
Metabolism/Metabolites
Volatile hydrocarbons are absorbed mainly through the lungs, and may also enter the body after ingestion via aspiration. (A600)
Volatile hydrocarbons are absorbed mainly through the lungs, and may also enter the body after ingestion via aspiration. (A600)
용도 및 제조
Uses
Octanes may be found in gasoline. (L1296)
Octanes may be found in gasoline. (L1296)
공급사21 곳
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
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