2-브로모-5-플루오로벤즈알데히드

2-Bromo-5-fluorobenzaldehyde

HCID 2773321CAS 94569-84-3

기본 정보

표준 SMILES
O=Cc1cc(F)ccc1Br
InChIKey
CJUCIKJLMFVWIS-UHFFFAOYSA-N
분자식
C7H4BrFO
평균 분자량
203.01 g/mol
단동위원소 질량
201.94295507

개요

structure in first source

이름 및 식별자

우선 이름
2-Bromo-5-fluorobenzaldehyde
IUPAC
2-bromo-5-fluorobenzaldehyde
현지명
2-브로모-5-플루오로벤즈알데히드
영어명
2-Bromo-5-fluorobenzaldehyde
분자식
C7H4BrFO
분자량
203.01

이름 및 동의어

2-Bromo-5-fluorobenzaldehyde94569-84-3DTXSID40378371RefChem:85767DTXCID90329398619-047-9MFCD001428722-bromo-5-fluoro-benzaldehydeSCHEMBL423912-Bromo-5-fluorobenzaldehyde, 96%SBB052173AKOS005259261
이름 더 보기
2-브로모-5-플루오로벤즈알데히드2-BROMO-5-FLUOROBENZALDHYDE2-bromo-5-fluorobenzaldehydy5-Fluoro-2-Bromo benzaldehydeBenzaldehyde, 2-broMo-5-fluoro-2-Bromo-5-fluorobenzaldehyde 96%2-Bromo-5-fluorobenzaldehyde >2-Bromo-5-fluorobenzaldehyde ,98%2-BroMo-5-fluorobenzaldehyde, 95+%2-Bromo-5-fluorobenzaldehyde ISO 9001:2015 REACH
AB03821AC-2292CS-W001148FB63995PS-8172SY002530DB-006013NS00120707

데이터베이스 식별자

CAS
94569-84-3
PubChem CID
2773321
DTXSID
DTXSID40378371
EC Number
619-047-9
Nikkaji
J2.002.877G

물성

구조 계산 물성

XLogP
2.2
극성 표면적
17.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
10

물리화학적 성질

녹는점
51 · 51-56 °C (lit.)
끓는 점
225.8 · 225.8±20.0 °C(Predicted)
밀도
1.67 · 1.670±0.06 g/cm3(Predicted)
인화점
190 °F · 190 °F
저장 조건
2 · 2-8°C
용해도
메탄올에 용해됩니다.

화학적 성질

White to light yellow solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (11.1%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 9 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 (11.1%)

안전 데이터

wgk
3
HS 번호
29130000
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36/37/39-24/25
위험 참고 사항
Irritant

화학 및 산업

응용 분야 · 2건

용도2-Bromo-5-fluorobenzaldehyde is used as a precursor for the synthesis of 5-fluoro-3-substituted benzoxaboroles, which is used in material science as molecular receptors, building block in crystal engineering, as steroid conjugates for molecular imprinting , dyes and biosensors of alpha hydroxyl carboxylic acids. It is also used in the synthesis of 5-arylindazolo[3,2-b]quinazolin-7(5H)-one by reacting with 2-amino-N'-arylbenzohydrazide in the presence of Copper(I) bromide by the Ullmann-type reaction.

일반 설명2-Bromo-5-fluorobenzaldehyde can be prepared by reacting 2-bromo-5-fluorotoluene with N-bromosuccinimide. Its crystals exhibit monoclinic crystal system and space group P21/c.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
上海赫文斯化工有限公司15721252604 17321035817 · [email protected]

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