3,5-디브로모살리실알데히드

3,5-Dibromosalicylaldehyde

HCID 7024CAS 90-59-5

기본 정보

표준 SMILES
O=Cc1cc(Br)cc(Br)c1O
InChIKey
JHZOXYGFQMROFJ-UHFFFAOYSA-N
분자식
C7H4Br2O2
평균 분자량
279.91 g/mol
단동위원소 질량
277.85780357

개요

structure in Merck Index, 9th ed, #2995

이름 및 식별자

우선 이름
3,5-Dibromosalicylaldehyde
IUPAC
3,5-dibromo-2-hydroxybenzaldehyde
현지명
3,5-디브로모살리실알데히드
영어명
3,5-Dibromosalicylaldehyde
분자식
C7H4Br2O2
분자량
279.91

이름 및 동의어

3,5-DIBROMOSALICYLALDEHYDE3,5-Dibromo-2-hydroxybenzaldehyde90-59-57A260PBI3ANSC-6221DTXSID1021796RefChem:91447DTXCID601796202-003-4DalydeBenzaldehyde, 3,5-dibromo-2-hydroxy-3,5-Dibromosalicylaldeyde
이름 더 보기
3,5-디브로모살리실알데히드AKOS B028985AKOS BBS-00003256OTAVA-BB BB7018801957SALOR-INT L497649-1EALABOTEST-BB LT00137784DibroMosalicylaldehydeDembrexine EP Impurity C5-DibroMosalicylaldehyde
2-Hydroxy-3,5-dibromobenzaldehydeMFCD00003318Salicylaldehyde, 3,5-dibromo-4,6-Dibromo-2-formylphenol; Dalyde; NSC 62213,5-dibromo-2-hydroxy-benzaldehydeSalicylaldehyde,5-dibromo-3,5-dibromo-salicylaldehydeCHEMBL229251

데이터베이스 식별자

CAS
90-59-5
PubChem CID
7024
DTXSID
DTXSID1021796
ChEMBL
CHEMBL229251
UNII
7A260PBI3A
EC Number
202-003-4
Nikkaji
J4.323K

물성

구조 계산 물성

XLogP
3
극성 표면적
37.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
11

물리화학적 성질

녹는점
82 · 82-83.5 °C (lit.)
끓는 점
261.2 · 261.2±35.0 °C(Predicted)
밀도
1.9661 · 1.9661 (rough estimate)
굴절률
1.497 · 1.4970 (estimate)
저장 조건
Keep in dark place,Sealed in dry,Room Temperature
용해도
25 mg/mL, · 메탄올: 용해성25mg/mL, 투명, 노란색에서 갈색
화학적 성질 · 1건

yellow to yellow-brown crystalline powder.3,5-Dibromosalicylaldehyde has an aromatic odor, and like salicylaldehyde, the compound colors the skin bright yellow. It is readily soluble in ether, benzene, chloroform, and hot alcohol. It imparts a yellow colour to cold water and is slightly soluble in boiling water, so it may be purified by distillation with steam. With the addition of sodium hydroxide, the brilliant yellow sodium salt separates; it is difficultly soluble in cold water or alcohol but more readily soluble when heated with these solvents.

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (92.5%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 53 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationStatus: Active Update: 12-06-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/19749
Hazard Classes and CategoriesSkin Irrit. 2 (92.5%)

안전 데이터

wgk
3
rtecs
CU5609000
ridadr
UN 3077 9 / PGIII
HS 번호
29130000
risk_code
36/37/38
hazard_code
Xi

화학 및 산업

응용 분야 · 2건

용도3,5-Dibromosalicylaldehyde reacts with alkyl cyanoacetates in the presence of ammonium acetate to yield 4H- chromenes. It can be used in the synthesis of Schiff base and can be used as reactant for synthesis of Schiff base ligands which forms mononuclear complexes with copper(II), nickel(II), zinc(II) and cobalt(II).

일반 설명3,5-Dibromosalicylaldehyde reacts with alkyl cyanoacetates in the presence of ammonium acetate to yield 4H- chromenes.

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
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]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Changzhou Carman Chemical Co., Ltd.15061933924

관련 반응

22건

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