4-피페콜린

4-메틸피페리딘 · 4-피페콜린 · 메틸피페리딘 · 4PPC · 4-PIPECOLINE · Piperidine, 4-methyl- · 4-Methylpiperidine solution · 4Me-Pip

https://huagongshe.com/ko/chemical/69381

식별자 및 물리적 특성

CAS No.	626-58-4
분자식	C6H13N
평균 분자량	99.17 g/mol
단동위원소 질량	99.10479942 g/mol
SMILES	CC1CCNCC1
InChIKey	UZOFELREXGAFOI-UHFFFAOYSA-N
PubChem CID	69381
ChEMBL	CHEMBL21533
EC No.	210-954-1
DTXSID	DTXSID8060820
현지명	4-피페콜린

화학 및 물리적 성질

XLogP	1.1
극성 표면적	12
수소 결합 공여자 수	1
수소 결합 수용자 수	1
회전 가능 결합 수	0
무거운 원자 수	7
형식 전하	0
복잡도	46
Physical Description	Colorless liquid with an amine-like odor[Alfa Aesar MSDS]
Kovats Retention Index	83181610771075
녹는점	4-5 °C
끓는 점	124 °C(lit.)
밀도	0.838 g/mL at 25 °C(lit.)
증기압	16 hPa (20 °C)
굴절률	n20/D 1.446(lit.)
인화점	45 °F
저장 조건	Flammables area
용해도	클로로포름에 용해됨
물리적 상태	액체
pKa(산도 계수)	pK1:11.23(+1) (25°C,μ=0.5)
비중	0.838
색상	약간 노란색으로 맑음
pH	13 (100g/l, H2O, 20℃)
용해도	혼용 가능
BRN	1083
InChI	1S/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3
InChIKey	UZOFELREXGAFOI-UHFFFAOYSA-N
SMILES	CC1CCNCC1
NIST	Piperidine, 4-methyl-(626-58-4)
EPA	Piperidine, 4-methyl- (626-58-4)

화학적 성질

clear slightly yellow liquid

안전 및 규제

GHS 분류	DangerH225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]H302 (12.3%): Harmful if swallowed [Warning Acute toxicity, oral]H314 (27.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]H315 (70.8%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (70.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (70.8%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 65 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
규제 정보	Chemical: Piperidine, 4-methyl-Status: Active Update: 13-05-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/194054-Methylpiperidine: Does not have an individual approval but may be used under an appropriate group standard
유해성 요약	Causes burnsInhalation may cause corrosive injuries to upper respiratory tract and lungs[Alfa Aesar MSDS] See Piperidine.
Hazard Classes and Categories	Flam. Liq. 2 (100%)Acute Tox. 4 (12.3%)Skin Corr. 1A (27.7%)Skin Irrit. 2 (70.8%)Eye Irrit. 2 (70.8%)STOT SE 3 (70.8%)
유해 작용	Dermatotoxin - Skin burns.Toxic Pneumonitis - Inflammation of the lungs induced by inhalation of metal fumes or toxic gases and vapors.

용도

4-Methylpiperidine is used as a catalyst in the synthesis of stilbene derivatives as anti-malarial agents. It also serves as an anti-corrosive compound for iron.