1-Indanone, 6-bromo-

HCID 139778CAS 14548-39-1

기본 정보

표준 SMILES
O=C1CCc2ccc(Br)cc21
InChIKey
SEQHEDQNODAFIU-UHFFFAOYSA-N
분자식
C9H7BrO
평균 분자량
211.05 g/mol
단동위원소 질량
209.96802694

이름 및 식별자

우선 이름
1-Indanone, 6-bromo-
IUPAC
6-bromo-2,3-dihydroinden-1-one
영어명
6-Bromoindanone
분자식
C9H7BrO
분자량
211.06

이름 및 동의어

14548-39-16-bromo-2,3-dihydro-1H-inden-1-one1-Indanone, 6-bromo-DTXSID50163053RefChem:433223DTXCID9085544688-934-06-Bromo-1-indanone6-Bromoindanone6-bromo-2,3-dihydroinden-1-one6-bromoindan-1-one6-Bromo-indan-1-one
이름 더 보기
6-BROMO INDANONE6-broindone6-BroMoindaonoe6-bromofluorenone6-Bromo-1-indanone>
MFCD021792861H-Inden-1-one, 6-bromo-2,3-dihydro-B3711EN300-839756-Bromo-2,3-dihydroinden-1-one;6-Bromo-1-indanoneF2189-00556-bromo-indanone6-Bromo-2,3-dihydro-1H-inden-1-one; 6-Bromo-2,3-dihydro-1H-inden-1-one;

데이터베이스 식별자

CAS
14548-39-1
PubChem CID
139778
DTXSID
DTXSID50163053
EC Number
688-934-0
Nikkaji
J618.939C

물성

구조 계산 물성

XLogP
2.4
극성 표면적
17.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
0
무거운 원자 수
11

실험 및 물리화학적 성질

SpringerMaterials PropertiesChemical shift

물리화학적 성질

녹는점
111 · 111-115 °C(lit.)
끓는 점
291.6 · 291.6±29.0 °C(Predicted)
밀도
1.608 · 1.608±0.06 g/cm3(Predicted)
저장 조건
Inert atmosphere,Room Temperature
물리적 상태
결정질 분말 또는 바늘
색상
흰색에서 노란색으로
화학적 성질 · 1건

6-Bromoindanone, also known as 6-bromo-1-indanone, is a white to yellow crystalline powder or needle-like solid with a specific chemical structure comprising an indanone ring system substituted with a bromine atom. Its maximum absorption wavelength (λmax) in ethanol is 302 nm.

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (37.5%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 8 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (37.5%)

안전 데이터

wgk
3
HS 번호
29147000
safety_code
24/25
스토리지 클래스
13 - Non Combustible Solids

화학 및 산업

응용 분야

용도6-Bromo-1-indanone is used as an organic chemical synthesis intermediate.

제조 방법 · 1건

Synthesis of 6-Bromoindanone: Trifluoromethanesulfonic acid (0.35 mL, 4 mmol) was added to a solution of the amide substrate 3-(4-Bromophenyl)-N-(4-nitrophenyl)propanamide (6) (1 mmol) in anhydrous CHCl₃ or CH₂Cl₂ (2 mL). The mixture was stirred for 4 h and then poured into ice. The product was extracted with CHCl₃, and the organic layer was washed with H₂O and brine, then dried over anhydrous sodium sulfate. The crude product was isolated and purified by column chromatography (hexane:ethyl acetate).Recovery of nitro-substituted aniline: The aqueous layer was made basic by the addition of 10 M NaOH, and the solution was extracted with CHCl₃. The organic layer was washed with H₂O and brine (2×), then dried over anhydrous sodium sulfate to yield 6-bromoindanone in 88% yield[1].

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
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INTATRADE GmbH+49 3493/605464 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

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