2-플루오로-4-히드록시벤즈알데히드

2-플루오로-4-히드록시벤즈알데히드 · 3-Fluoro-4-formylphenol · 2-Fluoro-6-nitroacetophenone · 2-FLURO-4-HYDROXYBENZALDEHYDE · 2-FLUORO-4-HYDROXYBENZALDEHYDE · Benzaldehyde, 2-fluoro-4-hydroxy- · 2-Fluoro-4-hydroxybenzaldehyde,98%

https://huagongshe.com/ko/chemical/587246

식별자 및 물리적 특성

CAS No.	348-27-6
분자식	C7H5FO2
평균 분자량	140.11 g/mol
단동위원소 질량	140.02735762 g/mol
SMILES	O=Cc1ccc(O)cc1F
InChIKey	ONRPXRPUBXXCCM-UHFFFAOYSA-N
PubChem CID	587246
ChEMBL	CHEMBL1650249
EC No.	642-692-2
DTXSID	DTXSID30343078
현지명	2-플루오로-4-히드록시벤즈알데히드

화학 및 물리적 성질

XLogP	1.1
극성 표면적	37.3
수소 결합 공여자 수	1
수소 결합 수용자 수	3
회전 가능 결합 수	1
무거운 원자 수	10
형식 전하	0
복잡도	127
녹는점	168-170°C
끓는 점	254.2±20.0 °C(Predicted)
밀도	1.350±0.06 g/cm3(Predicted)
저장 조건	under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태	결정성 분말
pKa(산도 계수)	6.78±0.18(Predicted)
색상	베이지색
InChI	InChI=1S/C7H5FO2/c8-7-3-6(10)2-1-5(7)4-9/h1-4,10H
InChIKey	ONRPXRPUBXXCCM-UHFFFAOYSA-N
SMILES	C(=O)C1=CC=C(O)C=C1F

안전 및 규제

GHS 분류	WarningH315 (100%): 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 37 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
관세 코드	2912490090
위험 문구(R)	22-37/38-41-52
위험 표시	Xi,Xn
안전 문구(S)	26-39
위험 참고 사항	Irritant

용도

2-Fluoro-4-hydroxybenzaldehyde is a useful reagent for preparation of 3,4-ring fused 7-azaindoles and deazapurines as potent JAK2 inhibitors.

용도

2-Fluoro-4-hydroxybenzaldehyde is mainly used as an intermediate for physiologically active compounds such as pharmaceuticals or pesticides and is a wide range of organic building blocks. Its structure contains fluorine, aldehyde groups, and phenolic hydroxyl groups, and these groups can add or replace other functional groups.