2,4-디히드록시벤즈알데히드

2,4-Dihydroxybenzaldehyde

HCID 7213CAS 95-01-2
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=Cc1ccc(O)cc1O
InChIKey
IUNJCFABHJZSKB-UHFFFAOYSA-N
분자식
C7H6O3
평균 분자량
138.12 g/mol
단동위원소 질량
138.03169405

개요

2,4-dihydroxybenzaldehyde is a dihydroxybenzaldehyde that is resorcinol which has been substituted by a formyl group para to one of the hydroxy groups.

이름 및 식별자

우선 이름
2,4-Dihydroxybenzaldehyde
IUPAC
2,4-dihydroxybenzaldehyde
현지명
2,4-디히드록시벤즈알데히드
영어명
2,4-Dihydroxybenzaldehyde
분자식
C7H6O3
분자량
138.12

이름 및 동의어

2,4-DIHYDROXYBENZALDEHYDE95-01-2beta-ResorcylaldehydeBenzaldehyde, 2,4-dihydroxy-b-resorcylaldehyde.beta.-Resorcylaldehydebeta-Rosorcaldehyde2,4-Dihydroxybenzaldehydb-ResorcaldehydeUNII-772JOF6LZSb-ResorcinaldehydeEINECS 202-383-1
이름 더 보기
2,4-다이하이드록시벤즈알데하이드2,4-디히드록시벤즈알데히드4-HydroxysalicylaldehydeBETA-RESORCYLIC ALDEHYDE2,4-Dihydroxybenzaldehyde(-Resorcylaldehyde)NC 012NSC 86904-DihydroxAKOS 227-33β-ResorcaldehydeAKOS BBS-00003187
772JOF6LZSBRN 0878548b-Resorcylic aldehydeCHEBI:50198AI3-24367NSC-8690DTXSID80218064-08-00-01753 (Beilstein Handbook Reference)

데이터베이스 식별자

CAS
95-01-2
PubChem CID
7213
DTXSID
DTXSID8021806
ChEMBL
CHEMBL243587
ChEBI
CHEBI:50198
UNII
772JOF6LZS
EC Number
202-383-1
Nikkaji
J4.706F

물성

구조 계산 물성

XLogP
1.5
극성 표면적
57.5 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
3
회전 가능 결합 수
1
무거운 원자 수
10

실험 및 물리화학적 성질

SpringerMaterials PropertiesAngular frequency
Endocrine DisruptorsPotential endocrine disrupting compound

물리화학적 성질

녹는점
135 · 135-137 °C (lit.)
끓는 점
220 · 220-228 °C/22 mmHg (lit.)
밀도
1.2667 · 1.2667 (rough estimate)
굴절률
1.46 · 1.4600 (estimate)
인화점
220 °C/22mm · 220°C/22mm
저장 조건
30 °C · Store below +30°C.

화학적 성질

2,4-Dihydroxybenzaldehyde is cream to light brown solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, 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 53 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationChemical: Benzaldehyde, 2,4-dihydroxy-
Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
VH3600000
HS 번호
29124900
risk_code
22-36/37/38
hazard_code
Xn,Xi

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzaldehyde, 2,4-dihydroxy-: ACTIVE
응용 분야 · 2건

개요2,4-Dihydroxybenzaldehyde is a resorcinol (R144700) derivative with potent antioxidative and antibacterial activity.

일반 설명2,4-Dihydroxybenzaldehyde undergoes regioselective mono-benzylation reaction under extremely mild basic conditions. It undergoes condensation reaction with isonicotinic acid hydrazide in methanol to yield 2,4-dihydroxybenzaldehyde isonicotinoyl hydrazone, a new fluorescent reagent.

상·하류 제품 정보

하류 제품

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]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]

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