1-(4-플루오로벤조일)피페리딘-3-카르복실산

1-(4-플루오로벤조일)피페리딘-3-카르복실산 · Oprea1_409442 · Oprea1_130932 · 1-(4-fluorobenzoyl)nipecotic acid · 1-(4-Fluorobenzoyl)piperidine-3-carboxylic acid · 3-Piperidinecarboxylic acid, 1-(4-fluorobenzoyl)- · 1-[(4-fluorophenyl)-oxomethyl]-3-piperidinecarboxylic acid

https://huagongshe.com/ko/chemical/4713643

식별자 및 물리적 특성

CAS No.	436093-16-2
분자식	C13H14FNO3
평균 분자량	251.25 g/mol
단동위원소 질량	251.09577147 g/mol
SMILES	O=C(O)C1CCCN(C(=O)c2ccc(F)cc2)C1
InChIKey	RVLHLMFNCSEIHG-UHFFFAOYSA-N
PubChem CID	4713643
EC No.	981-299-3
현지명	1-(4-플루오로벤조일)피페리딘-3-카르복실산

화학 및 물리적 성질

XLogP	1.5
극성 표면적	57.6
수소 결합 공여자 수	1
수소 결합 수용자 수	4
회전 가능 결합 수	2
무거운 원자 수	18
형식 전하	0
복잡도	326

안전 및 규제

GHS 분류	WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]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)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Acute Tox. 4 (100%)Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)
위험 등급	IRRITANT