이소부틸벤젠

이소부틸벤젠
이소부틸벤젠 구조식 이미지
카스 번호:
538-93-2
한글명:
이소부틸벤젠
동의어(한글):
아이소-뷰틸벤젠;이소부틸벤젠
상품명:
Isobutylbenzene
동의어(영문):
2-METHYL-1-PHENYLPROPANE;Benzene,(2-methylpropyl)-;i-Butylbenzene;2-Benzylpropane;isobutyl-benzen;ISOBUTYLBENZENE;1-PHENYLISOBUTANE;1-ISOBUTYLBENZENE;ISOBUYTEL BENZENE;Benzene, isobutyl-
CBNumber:
CB0328155
분자식:
C10H14
포뮬러 무게:
134.22
MOL 파일:
538-93-2.mol
MSDS 파일:
SDS

이소부틸벤젠 속성

녹는점
-51 °C (lit.)
끓는 점
170 °C/736 mmHg (lit.)
밀도
0.853 g/mL at 25 °C (lit.)
증기압
4.2 mm Hg ( 37.7 °C)
굴절률
n20/D 1.486(lit.)
인화점
131 °F
저장 조건
Flammables area
용해도
물에 불용성이며 에탄올, 에테르, 벤젠 및 아세톤에 용해됩니다.
산도 계수 (pKa)
>14 (Schwarzenbach et al., 1993)
색상
무색 내지 거의 무색
폭발한계
0.8-6%(V)
수용성
0.01g/L
Merck
14,5134
BRN
1852218
Henry's Law Constant
(x 10-2 atm?m3/mol): 1.09 at 25 °C (Hine and Mookerjee, 1975)
Dielectric constant
2.3(Ambient)
InChIKey
KXUHSQYYJYAXGZ-UHFFFAOYSA-N
LogP
4.8 at 23℃ and pH6
CAS 데이터베이스
538-93-2(CAS DataBase Reference)
NIST
Benzene, (2-methylpropyl)-(538-93-2)
EPA
Isobutylbenzene (538-93-2)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
위험품 표기 Xi,N
위험 카페고리 넘버 10-36/37/38-50/53
안전지침서 26-36-61-60
유엔번호(UN No.) UN 3295 3/PG 3
WGK 독일 3
RTECS 번호 DA3550000
자연 발화 온도 802 °F
위험 등급 3
포장분류 III
HS 번호 29029000
그림문자(GHS): GHS hazard pictogramsGHS hazard pictograms
신호 어: Warning
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H226 인화성 액체 및 증기 인화성 액체 구분 3 경고
H315 피부에 자극을 일으킴 피부부식성 또는 자극성물질 구분 2 경고 GHS hazard pictograms P264, P280, P302+P352, P321,P332+P313, P362
예방조치문구:
P210 열·스파크·화염·고열로부터 멀리하시오 - 금연 하시오.
P302+P352 피부에 묻으면 다량의 물로 씻으시오.
NFPA 704
2
0

이소부틸벤젠 C화학적 특성, 용도, 생산

화학적 성질

Isobutyl Benzene is an organic, aromatic, neutral and colourless liquid that has a specific gravity of around 0.852. Less dense than water and insoluble in water, soluble in ethanol, ether, benzene and acetone. Vapors heavier than air.

물리적 성질

Clear, colorless, liquid with an odor resembling butylbenzene, tert-butylbenzene, ethylbenzene, or toluene. An odor threshold concentration of 80 μg/kg was reported (quoted, Verschueren, 1983)

용도

Isobutylbenzene is used as an intermediate for perfumery and analgesic anti-inflammatory (Ibuprofen). It is also used as an internal standard in the study of increased pigmentation and floral scent levels in Pap1-transgenic petunia.

정의

ChEBI: Isobutylbenzene is an alkylbenzene that is benzene carrying an isobutyl substituent.

제조 방법

Isobutylbenzene synthesis: Isobutyrophenone, underwent a Wolff–Kishner reduction using hydrazine hydrate and strong base conditions to synthesize isobutyl benzene. The solvent for this reaction was replaced with the more sustainable solvent glycerol. The glycerol for this reaction was obtained from the synthesis of biodiesel. The reaction was allowed to heat at reflux (149–155 °C) for a period of three hours. An average 51 % yield of isobutyl benzene was obtained from the solar synthesis, compared to a 55 % yield from an in-lab, electrical heating analysis.
synthesis of Isobutylbenzene

일반 설명

Isobutylbenzene is synthesized by the isopropylation at the side chain over Na, K and Cs exchanged zeolites.

위험도

Moderate fire risk. Toxic in high concentration, a skin and eye irritant.

환경귀착

Biological. Oxidation of isobutylbenzene by Pseudomonas desmolytica S44B1 and Pseudomonas convexa S107B1 yielded 3-isobutylcatechol and (+)-2-hydroxy-8-methyl-6-oxononanoic acid (Jigami et al., 1975).
Chemical/Physical. Complete combustion in air yields carbon dioxide and water vapor. Isobutylbenzene will not hydrolyze because it has no hydrolyzable functional group.

이소부틸벤젠 준비 용품 및 원자재

원자재

준비 용품


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