5-에틸-2-푸랄데하이드

5-Ethyl-2-furaldehyde

HCID 89989CAS 23074-10-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCc1ccc(C=O)o1
InChIKey: XADGZBXFWQHBDB-UHFFFAOYSA-N
분자식: C7H8O2
평균 분자량: 124.14 g/mol
단동위원소 질량: 124.0524295

개요

5-Ethyl-2-furaldehyde has been reported in Picea abies with data available.

이름 및 식별자

우선 이름: 5-Ethyl-2-furaldehyde
IUPAC: 5-ethylfuran-2-carbaldehyde
현지명: 5-에틸-2-푸랄데하이드
영어명: 5-ETHYL-2-FURALDEHYDE
분자식: C7H8O2
분자량: 124.14

이름 및 동의어

5-Ethyl-2-furaldehyde5-ethylfuran-2-carbaldehyde23074-10-42-Furancarboxaldehyde, 5-ethyl-5-EthylfurfuralEINECS 245-411-8DTXSID80177643RefChem:102546DTXCID40100134245-411-8InChI=1/C7H8O2/c1-2-6-3-4-7(5-8)9-6/h3-5H,2H2,1HXADGZBXFWQHBDB-UHFFFAOYSA-N

이름 더 보기

5-에틸-2-푸랄데하이드5-ETHYL-2-FURALDEHYDASISCHEM D292635-Ethyl-2-furfuralTIMTEC-BB SBB010056Furfural Impurity 20Furfural Impurity 34ASINEX-REAG BAS 127197055-Ethyl-2-furaldehyde,98%

5-Ethyl-furan-2-carbaldehydeMFCD000306055-ethylfuran-2-carboxaldehyde5-ethylfurfuraldehydeYYH2MYA6S72-Furaldehyde, 5-ethyl-5-ethyl-2-furancarboxaldehydeSCHEMBL157526

데이터베이스 식별자

CAS: 23074-10-4
PubChem CID: 89989
DTXSID: DTXSID80177643
UNII: YYH2MYA6S7
EC Number: 245-411-8
Nikkaji: J318.396C

물성

구조 계산 물성

XLogP: 1.1
극성 표면적: 30.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 9
형식 전하: 0
복잡도: 101

물리화학적 성질

끓는 점: 79 · 79-81 °C/12 mmHg (lit.)
밀도: 1.055 g/mL · 1.055 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.522(lit.)
인화점: 150 °F · 150 °F
저장 조건: 2 · Sealed in dry,2-8°C
물리적 상태: liquid
Specific Gravity: 1.055 · 1.055
BRN: 1982 · 1982
InChI: 1S/C7H8O2/c1-2-6-3-4-7(5-8)9-6/h3-5H,2H2,1H3
InChIKey: XADGZBXFWQHBDB-UHFFFAOYSA-N
SMILES: [H]C(=O)c1ccc(CC)o1
LogP: 1.179 · 1.179 (est)

화학적 성질

clear colorless to dark yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H227 (100%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 4 (100%)

안전 데이터

wgk: 3
HS 번호: 29321900
hazard_code: Xi
safety_code: 24/25
위험 등급: IRRITANT
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야

용도5-Ethyl-2-furaldehyde was used in the synthesis of N-(tert-butoxycarbonyl)-3-(benzoxazol-5-yl)alanine methyl ester derivatives.

상·하류 제품 정보

상류 원료

공급사44 곳

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]

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