2-헥사노일푸란

2-Furyl pentyl ketone

HCID 61738CAS 14360-50-0

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCCCCC(=O)c1ccco1
InChIKey: YUAYWSBSIJVIBS-UHFFFAOYSA-N
분자식: C10H14O2
평균 분자량: 166.22 g/mol
단동위원소 질량: 166.09937969

개요

Pentyl 2-furyl ketone is an aromatic ketone.

이름 및 식별자

우선 이름: 2-Furyl pentyl ketone
IUPAC: 1-(furan-2-yl)hexan-1-one
현지명: 2-헥사노일푸란
영어명: 2-Hexanoylfuran
분자식: C10H14O2
분자량: 166.22

이름 및 동의어

2-Hexanoylfuran14360-50-01-(furan-2-yl)hexan-1-one2-Furyl pentyl ketonePentyl 2-furyl ketone1-Hexanone, 1-(2-furanyl)-1-(2-Furyl)-1-hexanone1-(2-Furyl)hexanone1-(2-Furanyl)-1-hexanoneFEMA No. 34181-Hexanone, 1-(2-furyl)-EINECS 238-333-0

이름 더 보기

2-헥사노일푸란FEMA 34182-HexanoylfuraneFuran, 2-hexanoylTIMTEC-BB SBB008342Amyl 2-furyl ketone2-HEXANOYLFURAN 98%N-AMYL 2-FURYL KETONEPENTYL-2-FURYL KETONE

NSC 27361NSC-27361AI3-2655653176V524SDTXSID1065760PENTYL 2-FURYL KETONE [FHFI]RefChem:472796DTXCID6034681

데이터베이스 식별자

CAS: 14360-50-0
PubChem CID: 61738
DTXSID: DTXSID1065760
ChEBI: CHEBI:195780
UNII: 53176V524S
EC Number: 238-333-0
Nikkaji: J47.696J

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 30.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 5
무거운 원자 수: 12
형식 전하: 0
복잡도: 143

실험 및 물리화학적 성질

Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food

Density0.992-0.998

Flavoring AgentsEU Flavoring substances

Solubility · 2건

Slightly soluble in water

Soluble (in ethanol)

Boiling Point65-67 °C (0.5 mm Hg)

Refractive Index1.490-1.496

물리화학적 성질

끓는 점: 125 · 125-127°C 15mm
밀도: 0.994 · 0.994
굴절률: 1.489 · 1.4890
FEMA: 3418 · 3418 | PENTYL 2-FURYL KETONE
인화점: 125 · 125-127°C/15mm
용해도: 혼합하기가 어렵습니다.
물리적 상태: liquid
냄새: 1 % · 디프로필렌 글리콜 중 1.00%. 달콤한 과일 케톤 그린 살구 복숭아
냄새 유형: 과일 같은
JECFA Number: 1512 · 1512
BRN: 2956 · 2956
InChI: 1S/C10H14O2/c1-2-3-4-6-9(11)10-7-5-8-12-10/h5,7-8H,2-4,6H2,1H3
InChIKey: YUAYWSBSIJVIBS-UHFFFAOYSA-N
SMILES: CCCCCC(=O)c1ccco1
LogP: 2.64 · 2.64
EPA: 1 · 1-Hexanone, 1-(2-furanyl)- (14360-50-0)

화학적 성질

Pentyl-2-furyl ketone has an apricot, peach-like odor.

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 77.8% (91 of 117) of all reports.

Warning

H315 (22.2%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 117 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: 1-Hexanone, 1-(2-furanyl)-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

1-Hexanone, 1-(2-furanyl)-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Hazard Classes and CategoriesSkin Irrit. 2 (22.2%)

안전 데이터

wgk: WGK 3
tsca: TSCA listed
HS 번호: 2932190090
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36/37/39
위험 참고 사항: Irritant
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

약리 정보

Cellular LocationsMembrane

용도 및 제조

Use Classification · 3건

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

General Manufacturing Information1-Hexanone, 1-(2-furanyl)-: INACTIVE

응용 분야

용도2-Hexanoylfuran is used as a food additives

상·하류 제품 정보

상류 원료

공급사37 곳

南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

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