2-(4-플루오로벤조일)벤조 산

2-(4-플루오로벤조일)벤조산 · 2-(4-FLUOROBENZOYL)벤조산 · BUTTPARK 121\15-83 · 2-(P-FLUOROBENZOYL)BENZOIC ACID · 2-(4-Fluorobenzoyl)benzoic acid · Benzoic acid, 2-(4-fluorobenzoyl)- · 2-(4-Fluorobenzoyl)benzoic acid 97% · 4-Fluorobenzophenone-2'-carboxylic acid

https://huagongshe.com/ko/chemical/82099

식별자 및 물리적 특성

CAS No.	7649-92-5
분자식	C14H9FO3
평균 분자량	244.22 g/mol
단동위원소 질량	244.05357237 g/mol
SMILES	O=C(O)c1ccccc1C(=O)c1ccc(F)cc1
InChIKey	FJAZVXUPZQSZKI-UHFFFAOYSA-N
PubChem CID	82099
ChEMBL	CHEMBL82115
EC No.	231-604-4
DTXSID	DTXSID40227294
현지명	2-(4-플루오로벤조일)벤조 산

화학 및 물리적 성질

XLogP	2.6
극성 표면적	54.4
수소 결합 공여자 수	1
수소 결합 수용자 수	4
회전 가능 결합 수	3
무거운 원자 수	18
형식 전하	0
복잡도	321
녹는점	138-140 °C (lit.)
물리적 상태	solid
InChI	1S/C14H9FO3/c15-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)14(17)18/h1-8H,(H,17,18)
InChIKey	FJAZVXUPZQSZKI-UHFFFAOYSA-N
SMILES	OC(=O)c1ccccc1C(=O)c2ccc(F)cc2

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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
수질 위해 등급(WGK)	3
관세 코드	2918300090
저장 분류	11 - Combustible Solids

용도

2-(4-Fluorobenzoyl)benzoic acid was used to prepare starting material for the synthesis of 9-fluoro-7H-benz(de)anthracene-7-one. It was used as starting reagent for the synthesis of Heparan sulfate glycosaminoglycans (HSGAG)-mimetic compounds.

일반 설명

2-(4-Fluorobenzoyl)benzoic acid on nitration with fuming HNO3 yields 2-(4-fluoro-3-nitrobenzoyl)benzoic acid.