기본 정보
- 표준 SMILES
CCCCCCCCOCCCCCCCC- InChIKey
NKJOXAZJBOMXID-UHFFFAOYSA-N- 분자식
- C16H34O
- 평균 분자량
- 242.44 g/mol
- 단동위원소 질량
- 242.26096571
개요
Di-n-octyl ether is a liquid. (NTP, 1992)
이름 및 식별자
- 우선 이름
- Dicaprylyl Ether
- IUPAC
- 1-octoxyoctane
- 현지명
- 다이카프릴릴에터
- 영어명
- DIOCTYL ETHER
- 분자식
- C16H34O
- 분자량
- 242.44
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
629-82-3- PubChem CID
- 12399
- DTXSID
DTXSID20862324- ChEBI
CHEBI:88651- UNII
- 77JZM5516Z
- EC Number
- 211-112-6、692-043-2
- Nikkaji
- J27.108J
물성
구조 계산 물성
- XLogP
- 6.9
- 극성 표면적
- 9.2 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 109
실험 및 물리화학적 성질
Cosmetics
Cosmetic ingredients (Dicaprylyl Ether) -> CIR (Cosmetic Ingredient Review)
Solvent
Personal care product
Physical Description
Di-n-octyl ether is a liquid. (NTP, 1992)
CBI; Liquid
Liquid; [CAMEO] Clear colorless liquid; [MSDSonline]
물리화학적 성질
- 녹는점
- 7.6 °C · −7.6 °C(lit.)
- 끓는 점
- 286 · 286-287 °C(lit.)
- 밀도
- 0.806 g/mL · 0.806 g/mL at 25 °C(lit.)
- 굴절률
- 20 · n20/D 1.433(lit.)
- 인화점
- 230 °F · >230 °F
- 저장 조건
- 2 · Storage temp. 2-8°C
- 용해도
- 20 °C에서 · 물: 20°C에서 용해성0.1g/L
- 물리적 상태
- 투명한 액체
- 색상
- 무색~연황색
- 수용성
- 0.1 g/L · water: soluble 0.1g/L at20°C
- BRN
- 1748226 · 1748226
- Henry's Law Constant
- 1.3 · 1.3×10-4 mol/(m3Pa) at 25℃, Yaws (2003)
- 안정성
- 안정적인. 타기 쉬운. 강한 산화제와 호환되지 않습니다.
- 화장품 원료 기능
- 피부 컨디셔닝피부 컨디셔닝 - 보습제용제
- InChI
- InChI=1S/C16H34O/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-16H2,1-2H3
- InChIKey
- NKJOXAZJBOMXID-UHFFFAOYSA-N
- SMILES
- O(CCCCCCCC)CCCCCCCC
- LogP
- 6.94 · 6.94
- EPA
- Di-n-octyl ether (629-82-3)
화학적 성질
colourless liquid
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (173 of 173) of all reports.
Not Classified
Aggregated GHS information provided per 173 reports by companies from 1 notifications to the ECHA C&L Inventory.
This chemical does not meet GHS hazard criteria for 100% (11 of 11) of all reports.
Not Classified
Aggregated GHS information provided per 11 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: Octane, 1,1'-oxybis-
Octane, 1,1'-oxybis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Octane, 1,1'-oxybis- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 20-12-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/2013
Octyl ether: Does not have an individual approval but may be used under an appropriate group standard
Reactivity Profile
DI-N-OCTYL ETHER, an ether, can act as a base. They form salts with strong acids and addition complexes with Lewis acids. The complex between diethyl ether and boron trifluoride is an example. Ethers may react violently with strong oxidizing agents. In other reactions, which typically involve the breaking of the carbon-oxygen bond, ethers are relatively inert.
Air and Water Reactions
Ethers tend to form unstable peroxides when exposed to oxygen. Ethyl, isobutyl, ethyl tert-butyl, and ethyl tert-pentyl ether are particularly hazardous in this respect. Ether peroxides can sometimes be observed as clear crystals deposited on containers or along the surface of the liquid.
Hazard Classes and Categories
Not Classified
Not Classified
안전 및 보호
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, you should dampen the solid spill material with alcohol, then transfer the dampened material to a suitable container. Use absorbent paper dampened with alcohol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with alcohol followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter.
독성 정보
안전 데이터
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- RH8800000
- HS 번호
- 29091990
- safety_code
- 23-24/25
- 기존화학 물질
- KE-11985
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
용도 및 제조
Uses
CIR ingredient: Dicaprylyl Ether
Used as an analytical reagent; [MSDSonline]
General Manufacturing Information
Not Known or Reasonably Ascertainable
Octane, 1,1'-oxybis-: ACTIVE
응용 분야
용도Dioctyl ether has been used in the preparation of:11nm-sized monodisperse iron nanoparticlescobalt ferrite nanocrystals with a particle diameter of 6nmCoPt-polymer nanostructured composites
일반 설명Liquid.
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