1-옥타놀

1-옥타놀
1-옥타놀 구조식 이미지
카스 번호:
111-87-5
한글명:
1-옥타놀
동의어(한글):
1-옥타놀;1-옥탄올;1-히드록시옥탄;N-옥탄올;옥타놀-1;옥탄올;옥틸알코올;일차옥틸알코올;카프릴알코올;헵틸카빈올;카프릴릴알코올;1-하이드록시옥탄;n-옥틸 알코올;옥틸 알코올;일차 옥틸 알코올;카프릴 알코올;헵틸 카빈올
상품명:
1-Octanol
동의어(영문):
OCTANOL;N-OCTANOL;caprylic;OCTAN-1-OL;OCTYL ALCOHOL;N-OCTYL ALCOHOL;1-Octano;N-CAPRYLIC ALCOHOL;Octilin;n-Octano
CBNumber:
CB4157940
분자식:
C8H18O
포뮬러 무게:
130.23
MOL 파일:
111-87-5.mol
MSDS 파일:
SDS

1-옥타놀 속성

녹는점
−15 °C(lit.)
끓는 점
196 °C(lit.)
밀도
0.827 g/mL at 25 °C(lit.)
증기 밀도
4.5 (vs air)
증기압
0.14 mm Hg ( 25 °C)
굴절률
n20/D 1.429(lit.)
FEMA
2800 | 1-OCTANOL
인화점
178 °F
저장 조건
Store below +30°C.
용해도
물: 23°C에서 부분적으로 용해됨107g/L
산도 계수 (pKa)
15.27±0.10(Predicted)
물리적 상태
액체
색상
APHA: ≤10
상대극성
0.537
냄새
알코올 같은
Odor Threshold
0.0027ppm
폭발한계
0.8%(V)
?? ??
밀랍같은
수용성
불용성
최대 파장(λmax)
λ: 215 nm Amax: 1.00
λ: 225 nm Amax: 0.50
λ: 235 nm Amax: 0.20
λ: 250 nm Amax: 0.05
λ: 300-400 nm Amax: 0.01
JECFA Number
97
Merck
14,6751
BRN
1697461
Dielectric constant
10.3(20℃)
안정성
안정적인. 가연성. 강한 산화제와 호환되지 않습니다.
InChIKey
KBPLFHHGFOOTCA-UHFFFAOYSA-N
LogP
3.5 at 23℃
CAS 데이터베이스
111-87-5(CAS DataBase Reference)
NIST
1-Octanol(111-87-5)
EPA
1-Octanol (111-87-5)
안전
  • 위험 및 안전 성명
  • 위험 및 사전주의 사항 (GHS)
위험품 표기 Xi
위험 카페고리 넘버 36/38
안전지침서 26-36/37-37/39
유엔번호(UN No.) 3082
WGK 독일 1
RTECS 번호 RH6550000
자연 발화 온도 523 °F
TSCA Yes
위험 등급 9
포장분류 III
HS 번호 29051680
유해 물질 데이터 111-87-5(Hazardous Substances Data)
독성 LD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rabbit > 2000 mg/kg
기존화학 물질 KE-26656
그림문자(GHS): GHS hazard pictograms
신호 어: Warning
유해·위험 문구:
암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드
H319 눈에 심한 자극을 일으킴 심한 눈 손상 또는 자극성 물질 구분 2A 경고 GHS hazard pictograms P264, P280, P305+P351+P338,P337+P313P
H412 장기적 영향에 의해 수생생물에 유해함 수생 환경유해성 물질 - 만성 구분 3 P273, P501
예방조치문구:
P264 취급 후에는 손을 철저히 씻으시오.
P264 취급 후에는 손을 철저히 씻으시오.
P273 환경으로 배출하지 마시오.
P280 보호장갑/보호의/보안경/안면보호구를 착용하시오.
P305+P351+P338 눈에 묻으면 몇 분간 물로 조심해서 씻으시오. 가능하면 콘택트렌즈를 제거하시오. 계속 씻으시오.
P337+P313 눈에 대한 자극이 지속되면 의학적인 조치· 조언를 구하시오.
P501 ...에 내용물 / 용기를 폐기 하시오.
NFPA 704
2
1 0

1-옥타놀 MSDS


Capryl alcohol

1-옥타놀 C화학적 특성, 용도, 생산

개요

1-Octanol (111-87-5) is a colorless and transparent liquid with the chemical formula C8H18O. It is a fatty alcohol consisting of a linear, saturated chain of eight carbon atoms. Although 1-Octanol is not highly soluble in water, it can dissolve easily in alcohol, ether, and chloroform. This compound is commonly used as a raw material in the production of fragrances, octanal, octanoic acid, and its esters. It also functions as a solvent, defoamer, and lubricating oil additive. Notably, 1-Octanol poses a low level of toxicity, but it can be irritating to the skin and eyes. Nonetheless, it is considered safe to use under normal conditions because of its low vapor pressure.

화학적 성질

1-Octanol has a fresh, orange-rose odor, quite sweet and an oily, sweet, slightly herbaceous taste.

출처

Reported as frequently occurring in essential oils as an ester; the free alcohol has been reported found in the essential oils of green tea, grapefruit, California orange, Andropogon intermedius, Heracleum villosum, violet leaves, Anethum graveolens and bitter orange. Also reported in over 200 foods and beverages including apple, apricot, banana, citrus peel oils and juices, many berries, guava, grapes, melon, papaya, peach, pear, asparagus, kohlrabi, leek, peas, tomato, potato, clove, ginger, mustard, spearmint oil, wheat bread, many cheeses, cooked egg, butter, milk, fish, meats, beer, rum, whiskies, cognac, cider, sherry, grape wines, cocoa, tea, nuts, honey, soybean, coconut, passion fruit, olive, avocado, plum, rose apple, beans, mushroom, starfruit, Bantu beer, sesame seed, cauliflower, broccoli, tamarind, fruit brandies, fig, cardamom, coriander seed and leaf, rice, quince, litchi, dill, lovage, sweet corn, corn oil, malt, kiwifruit, loquat, Bourbon vanilla, clary sage, oysters, crayfish, clam and Chinese quince.

생산 방법

1-Octanol is made commercially by sodium reduction or high-pressure catalytic hydrogenation of the esters of naturally occurring caprylic acid or by oligomerization of ethylene using aluminum alkyl technology.

정의

ChEBI: Octan-1-ol is an octanol carrying the hydroxy group at position 1. It has a role as a plant metabolite. It is an octanol and a primary alcohol.

제조 방법

1-Octanol may be prepared by reduction of some caprylic esters such as methyl caprylate with sodium ethoxide.

일반 설명

A clear colorless liquid with a penetrating aromatic odor. Insoluble in water and floats on water. Vapors heavier than air. Vapors may irritate the eyes, nose, and respiratory system.

공기와 물의 반응

Insoluble in water.

반응 프로필

Attacks plastics [Handling Chemicals Safely 1980. p. 236]. Acetyl bromide reacts violently with alcohols or water [Merck 11th ed. 1989]. Mixtures of alcohols with concentrated sulfuric acid and strong hydrogen peroxide can cause explosions. Example: an explosion will occur if dimethylbenzylcarbinol is added to 90% hydrogen peroxide then acidified with concentrated sulfuric acid. Mixtures of ethyl alcohol with concentrated hydrogen peroxide form powerful explosives. Mixtures of hydrogen peroxide and 1-phenyl-2-methyl propyl alcohol tend to explode if acidified with 70% sulfuric acid [Chem. Eng. News 45(43):73. 1967; J, Org. Chem. 28:1893. 1963]. Alkyl hypochlorites are violently explosive. They are readily obtained by reacting hypochlorous acid and alcohols either in aqueous solution or mixed aqueous-carbon tetrachloride solutions. Chlorine plus alcohols would similarly yield alkyl hypochlorites. They decompose in the cold and explode on exposure to sunlight or heat. Tertiary hypochlorites are less unstable than secondary or primary hypochlorites [NFPA 491 M. 1991]. Base-catalysed reactions of isocyanates with alcohols should be carried out in inert solvents. Such reactions in the absence of solvents often occur with explosive violence [Wischmeyer 1969].

건강위험

Irritates skin and eyes.

Safety Profile

Poison by intravenous route. Moderately toxic by ingestion. Mutation data reported. A skin irritant. Combustible liquid when exposed to heat or flame; can react with oxidizing materials. To fight fire, use water foam, fog, alcohol foam, dry chemical, CO2. See also ALCOHOLS.

Carcinogenicity

There was no evidence of tumors in the cancer screening lung adenoma study in which mice were injected intraperitoneally with 100 and 500 mg/kg 1- octanol three times a week for 8 weeks. This assay has not been validated as a reliable screen for cancer.
1-Octanol is a weak skin tumor promoter when applied three times a week for 60 weeks to mice skin that had been initiated with dimethylbenz[a]anthracene.

신진 대사

The primary aliphatic alcohols undergo two general reactions in vivo, namely oxidation to carboxylic acids and direct conjugation with glucuronic acid. The first reaction proceeds with the intermediate formation of an aldehyde, and the carboxylic acid from this may be either oxidized completely to carbon dioxide or excreted as such or combined with glucuronic acid as an ester glucuronide. The extent to which an alcohol undergoes the second reaction, i.e. direct conjugation to an ether glucuronide, appears to depend upon the speed of the first reaction, for alcohols which are rapidly oxidized form very little ether glucuronide unless given in high doses (Williams, 1959).

Purification Methods

Fractionally distil it under reduced pressure. Dry it with sodium and again fractionally distil or reflux with boric anhydride and re-distilled (b 195-205o/5mm), the distillate being neutralised with NaOH and again fractionally distilled. Also purify it by distillation from Raney nickel and by preparative GLC. [Beilstein 1 IV 1756.]

1-옥타놀 준비 용품 및 원자재

원자재

준비 용품


1-옥타놀 공급 업체

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