염화 이소뷰틸
Isobutyl chloride
기본 정보
- CAS
513-36-0- 표준 SMILES
CC(C)CCl- InChIKey
QTBFPMKWQKYFLR-UHFFFAOYSA-N- 분자식
- C4H9Cl
- 평균 분자량
- 92.57 g/mol
- 단동위원소 질량
- 92.03927797
이름 및 식별자
- 우선 이름
- Isobutyl chloride
- IUPAC
- 1-chloro-2-methylpropane
- 현지명
- 염화 이소뷰틸
- 영어명
- 1-Chloro-2-methylpropane
- 분자식
- C4H9Cl
- 분자량
- 92.57
이름 및 동의어
1-Chloro-2-methylpropaneISOBUTYL CHLORIDEPropane, 1-chloro-2-methyl-iso-C4H9ClUNII-95E08D17M7EINECS 208-157-995E08D17M72-CHLOROMETHYLPROPANE2-METHYLPROPYL CHLORIDEISOBUTYL CHLORIDE [MI]DTXSID40601532-METHYL-1-CHLOROPROPANE
이름 더 보기
1-클로로-2-메틸프로페인염화이소뷰틸클로로-2-메틸프로탄염화이소뷰틸이소부틸클로라이드3-CHLORO-2-METHYLPROPANEChloroisobutaneIsobutylchlorid1-CHLOROISOBUTANEiso-Chloro-butaneChloro-2-MethylpropCHLORO-2-METHYLPROPANE
UN11271Chloro2methylpropanePropane, 1chloro2methylRefChem:149078DTXCID7040996QTBFPMKWQKYFLR-UHFFFAOYSA-N513-36-01-chloro-2-methyl-propane
데이터베이스 식별자
- CAS
513-36-0- PubChem CID
- 10554
- DTXSID
DTXSID4060153- ChEMBL
CHEMBL160966- UNII
- 95E08D17M7
- EC Number
- 208-157-9
- Nikkaji
- J2.619K
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 5
- 형식 전하
- 0
- 복잡도
- 17.6
실험 및 물리화학적 성질
Chemical ClassesFlammable agents - 3rd degree
SolventsSolvents -> Chlorinated Aliphatics
SpringerMaterials PropertiesSchoenflies notation
LogP2.39
Density
Relative density (water = 1): 0.9
0.881 @ 20°C
SolubilitySolubility in water: none
Flash Point-10 °C
Boiling Point
69 °C
68.8 °C @760 [mm Hg]
Melting Point-131 °C
Vapor DensityRelative vapor density (air = 1): 3.2
Vapor Pressure150.0 [mmHg]
Physical Description
Colorless liquid; [ICSC]
COLOURLESS LIQUID.
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 1.2% (2 of 165) of reports.
Danger
H225 (98.8%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 165 reports by companies from 4 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: Propane, 1-chloro-2-methyl-
Status: Active Update: 13-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/20738
1-Chloro-2-methylpropane: Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
Fire HazardsHighly flammable. Gives off irritating or toxic fumes (or gases) in a fire. Vapour/air mixtures are explosive.
Hazards SummaryNo listed effects of short-term or long-term exposure; [ICSC] An irritant; [Alfa Aesar MSDS] See n-Butyl chloride.
UN ClassificationUN Hazard Class: 3; UN Pack Group: II
Chemical DangersDecomposes on burning. This produces toxic and corrosive fumes including hydrogen chloride (see ICSC 0163) and phosgene (see ICSC 0007). Reacts violently with strong oxidants and powdered metals. This generates fire and explosion hazard.
Physical DangersThe vapour is heavier than air and may travel along the ground; distant ignition possible. As a result of flow, agitation, etc., electrostatic charges can be generated.
화학 및 산업
용도 및 제조
General Manufacturing InformationPropane, 1-chloro-2-methyl-: ACTIVE
응용 분야
용도1-Chloro-2-methylpropane is used to prepare an organometllic compound, isobutyllithium by reacting with lithium using petroleum ether as a solvent.
일반 설명The gas-solid virial co-effiicent of 1-chloro-2-methylpropane was determined. The infrared and Raman spectra of 1-chloro-2-methylpropane was studied.
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