기본 정보
- CAS
6881-94-3- 표준 SMILES
CCCOCCOCCO- InChIKey
DJCYDDALXPHSHR-UHFFFAOYSA-N- 분자식
- C7H16O3
- 평균 분자량
- 148.2 g/mol
- 단동위원소 질량
- 148.10994437
이름 및 식별자
- 우선 이름
- Diethylene glycol monopropyl ether
- IUPAC
- 2-(2-propoxyethoxy)ethanol
- 현지명
- 2-(PROPOXYETHOXY)에탄올
- 영어명
- 2-(Propoxyethoxy)ethanol
- 분자식
- C7H16O3
- 분자량
- 148.2
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
6881-94-3- PubChem CID
- 81313
- DTXSID
DTXSID1027639- UNII
- T8K0B3U2HC
- EC Number
- 229-985-7
- Nikkaji
- J116.323J
물성
구조 계산 물성
- XLogP
- 0.2
- 극성 표면적
- 38.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 56.8
실험 및 물리화학적 성질
Physical Description
Liquid
Colorless liquid; [Eastman Chemical MSDS]
물리화학적 성질
- 녹는점
- -15.45 °C · -15.45°C (estimate)
- 끓는 점
- 212 · 212-216 °C(lit.)
- 밀도
- 0.969 g/mL · 0.969 g/mL at 25 °C(lit.)
- 굴절률
- 20 · n20/D 1.435(lit.)
- 인화점
- 210 °F · 210 °F
- 용해도
- water: soluble
- 산도 계수 (pKa)
- 14.37 · 14.37±0.10(Predicted)
- 수용성
- water: soluble
- InChI
- 1S/C7H16O3/c1-2-4-9-6-7-10-5-3-8/h8H,2-7H2,1H3
- InChIKey
- DJCYDDALXPHSHR-UHFFFAOYSA-N
- SMILES
- CCCOCCOCCO
- EPA
- 2 · Ethanol, 2-(2-propoxyethoxy)- (6881-94-3)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 10.4% (5 of 48) of reports.
Warning
H319 (83.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 48 reports by companies from 3 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Ethanol, 2-(2-propoxyethoxy)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethanol, 2-(2-propoxyethoxy)- 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)
Ethanol, 2-(2-propoxyethoxy)-: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
Acute toxicity in rodents includes CNS depression but no systemic toxicity in inhalation studies using less than continuous exposure regimens; Hemolysis in sub-chronic dermal studies and kidney and liver toxicity with some hematological changes in sub-chronic oral studies; No reproductive toxicity except one study showing testicular toxicity at very high doses; [Reference #1] May form peroxides; An eye irritant; [Eastman Chemical MSDS] See GLYCOL ETHERS.
독성 정보
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- risk_code
- 36
- hazard_code
- Xi
- safety_code
- 26
- Hazard Classifications
- Eye Irrit. 2
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
용도 및 제조
Uses
Used as a solvent in coatings, retarder solvent for inks, coalescing aid in paints, in automotive coatings, plastic coatings, and household cleaners; [Reference #1] Used as a solvent; [Eastman Chemical MSDS]
Painting (Solvents) [Category: Paint]
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Ethanol, 2-(2-propoxyethoxy)-: ACTIVE
응용 분야
일반 설명Diethylene glycol monopropyl ether (2-(2-Propoxyethoxy)ethanol) is one of the volatile organic compounds that is assumed to contribute to the aroma of Khao Dawk Mali 105 brown rice. Various thermophysical properties of diethylene glycol monopropyl ether have been derived.
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