2-에톡시테트라히드로푸란

Tetrahydro-2-hydroxyfuran

HCID 93002CAS 13436-46-9

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: OC1CCCO1
InChIKey: JNODDICFTDYODH-UHFFFAOYSA-N
분자식: C4H8O2
평균 분자량: 88.11 g/mol
단동위원소 질량: 88.05242949

이름 및 식별자

우선 이름: Tetrahydro-2-hydroxyfuran
IUPAC: oxolan-2-ol
현지명: 2-에톡시테트라히드로푸란
영어명: 2-ETHOXYTETRAHYDROFURAN
분자식: C6H12O2
분자량: 116.16

이름 및 동의어

2-Hydroxytetrahydrofuran5371-52-8Tetrahydro-2-furanol2-Furanol, tetrahydro-Tetrahydro-2-hydroxyfuranV8YVV52DLWCHEBI:19662RefChem:87621236-569-9tetrahydrofuran-2-oloxolan-2-oltetrahydrofuryl alcohol

이름 더 보기

2-에톡시테트라히드로푸란2-ethoxyoxolaneEinecs 236-569-92-ETHOXYTETRAHYDROFURANFuran, 2-ethoxytetrahydro-2-Ethoxytetrahydrofuran 99%

MFCD073694572-hydroxy-tetrahydrofuran.alpha.-HydroxytetrahydrofuranDTXSID50968469AKOS006286535AS-57322SY016132CS-0197674

데이터베이스 식별자

CAS: 13436-46-9、5371-52-8
PubChem CID: 93002
DTXSID: DTXSID50968469
ChEBI: CHEBI:19662
UNII: V8YVV52DLW
EC Number: 236-569-9
Nikkaji: J131.583H

물성

구조 계산 물성

XLogP: 0
극성 표면적: 29.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 0
무거운 원자 수: 6
형식 전하: 0
복잡도: 44

물리화학적 성질

끓는 점: 170 · 170-172 °C (lit.)
밀도: 0.908 g/mL · 0.908 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.414(lit.)
인화점: 61 °F · 61 °F
물리적 상태: liquid
InChI: 1S/C6H12O2/c1-2-7-6-4-3-5-8-6/h6H,2-5H2,1H3
InChIKey: JQYYUWHWGCJWTN-UHFFFAOYSA-N
SMILES: CCOC1CCCO1
LogP: 0.13 · 0.130 (est)

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H225 (100%): 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 39 reports by companies from 1 notifications to the ECHA C&L Inventory.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

안전 데이터

wgk: 3
ridadr: UN 1993 3/PG 2
risk_code: 11
hazard_code: F
safety_code: 16-29-33
포장분류: II
위험 등급: 3.1
Hazard Classifications: Flam. Liq. 2
스토리지 클래스: 3 - Flammable liquids

화학 및 산업

응용 분야 · 2건

용도2-Ethoxytetrahydrofuran was used to investigate quantitative, regioselective, O-acylative cleavage of tetrahydrofurans using organic acid halides in the presence of Bi(III) halides.

일반 설명2-Ethoxytetrahydrofuran undergoes Ln(OTf)3-catalyzed-Povarov coupling reaction with anilines and cyclopentadiene to yield tetrahydroquinolines. Transacetalization of 2-ethoxytetrahydrofuran with various alcohols catalyzed by Fe(ClO4)3 has been reported.