2-하이드록시-4-메톡시벤즈알데하이드
2-Hydroxy-4-Methoxybenzaldehyde
기본 정보
- CAS
673-22-3- 표준 SMILES
COc1ccc(C=O)c(O)c1- InChIKey
WZUODJNEIXSNEU-UHFFFAOYSA-N- 분자식
- C8H8O3
- 평균 분자량
- 152.15 g/mol
- 단동위원소 질량
- 152.04734411
개요
2-Hydroxy-4-methoxybenzaldehyde is a member of phenols and a member of methoxybenzenes.
이름 및 식별자
- 우선 이름
- 2-Hydroxy-4-Methoxybenzaldehyde
- IUPAC
- 2-hydroxy-4-methoxybenzaldehyde
- 현지명
- 2-하이드록시-4-메톡시벤즈알데하이드
- 영어명
- 2-Hydroxy-4-methoxybenzaldehyde
- 분자식
- C8H8O3
- 분자량
- 152.15
이름 및 동의어
2-Hydroxy-4-methoxybenzaldehyde673-22-34-MethoxysalicylaldehydeBenzaldehyde, 2-hydroxy-4-methoxy-o-Hydroxy-p-methoxybenzaldehydep-Anisaldehyde, 2-hydroxy-2-Hydroxy-p-anisaldehyde2-Formyl-5-methoxyphenol2N395P88LWDTXSID1060970NSC-155334FEMA NO. 4435
이름 더 보기
2-하이드록시-4-메톡시벤즈알데하이드2-하이드록시-4-메톡시벤즈알데하이드(2-HYDROXY-4-METHOXYBENZALDEHYDE)4-MthoxysalicylaldehydeAKOS 222-392-Hydroxy-4-methoxyb2-Hydroxyanisaldehyde2-hydroxy-p-anisaldehyd4-MethoxySalicyladehyde
RefChem:87419DTXCID9044873211-604-02-Hydroxy-4-methoxy-benzaldehyde4-MethoxysalicyaldehydeSalicylaldehyde, 4-methoxy-MFCD00003327Entacapone Impurity 65
데이터베이스 식별자
- CAS
673-22-3- PubChem CID
- 69600
- DTXSID
DTXSID1060970- ChEMBL
CHEMBL350966- ChEBI
CHEBI:183274- UNII
- 2N395P88LW
- EC Number
- 211-604-0
- Nikkaji
- J155.609F
물성
구조 계산 물성
- XLogP
- 1.5
- 극성 표면적
- 46.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 135
실험 및 물리화학적 성질
Food Additives
FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Food
Density1.231
Solubility
Slightly soluble
Soluble (in ethanol)
Endocrine DisruptorsPotential endocrine disrupting compound
Boiling Point271-274 °CC
Physical DescriptionWhite or yellow to beige crystal
물리화학적 성질
- 녹는점
- 41 · 41-43 °C (lit.)
- 끓는 점
- 124 °C · 124 °C / 12mmHg
- 밀도
- 1.2143 · 1.2143 (rough estimate)
- 굴절률
- 1.4447 · 1.4447 (estimate)
- FEMA
- 4435 · 4435 | 2-HYDROXY-4-METHOXYBENZALDEHYDE
- 인화점
- 230 °F · >230 °F
- 저장 조건
- 30 °C · Store below +30°C.
- 용해도
- 30 mg/ml; · DMF: 30 mg/ml; DMSO: 30 mg/ml; Ethanol: 30 mg/ml
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 10.5% (6 of 57) of reports.
Warning
H315 (89.5%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 57 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory InformationREACH registered substance: 4-methoxysalicylaldehyde (EC: 211-604-0)
Hazard Classes and CategoriesSkin Irrit. 2 (89.5%)
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- BZ2810000
- HS 번호
- 2912499000
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36-24/25
- 기존화학 물질
- KE-20614
- F 고인화성물질
- 10
- 위험 참고 사항
- Irritant
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
용도 및 제조
Use Classification
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing InformationBenzaldehyde, 2-hydroxy-4-methoxy-: ACTIVE
응용 분야
용도2-Hydroxy-4-methoxybenzaldehyde was used in the synthesis of Schiff base ligand.
일반 설명2-Hydroxy-4-methoxybenzaldehyde is the main component of root bark essential oil of Periploca sepium Bunge. It is a potential tyrosinase inhibitor present in African medicinal plants.
상·하류 제품 정보
상류 원료
관련 반응
100건
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