기본 정보
- CAS
155849-49-3- 표준 SMILES
Cl.FC(F)(F)C1CCNCC1- InChIKey
KMUKXPQVPQUCDB-UHFFFAOYSA-N- 분자식
- C6H11ClF3N
- 평균 분자량
- 189.6 g/mol
- 단동위원소 질량
- 189.05321169
이름 및 식별자
- 우선 이름
- 4-(Trifluoromethyl)piperidine hydrochloride
- IUPAC
- 4-(trifluoromethyl)piperidine;hydrochloride
- 현지명
- 4-(트리플루오로메틸)피페리딘 하이드로클로라이드
- 영어명
- 4-(Trifluoromethyl)piperidine hydrochloride
- 분자식
- C6H11ClF3N
- 분자량
- 189.61
이름 및 동의어
4-(Trifluoromethyl)piperidine hydrochlorideRefChem:517176625-412-3155849-49-34-(trifluoromethyl)piperidine hclMFCD049719934-(trifluoromethyl)piperidine;hydrochloridePiperidine, 4-(trifluoromethyl)-, hydrochloride (1:1)4-trifluoromethyl-piperidine hydrochloride4-Trifluoromethylpiperidine hydrochloride4-(trifluoromethyl)piperidinehydrochlorideEN300-249793
이름 더 보기
4-(트리플루오로메틸)피페리딘하이드로클로라이드4-(트리플루오로메틸)피페리딘염화물)piperidine hydrochL4-(trifluoromethyl)piperidin-1-ium4-(Trifluormethyl)piperidinhydrochlorid4-(TRIFLUOROMETHYL)PIPERIDINE HYDROCHLO&4-(Trifluoromethyl)piperidine hydrochloride 97%4-(trifluoromethyl)-Piperidine hydrochloride (1:1)
Piperidine, 4-(trifluoromethyl)-, hydrochlorideSCHEMBL207007DTXSID505847894-trifluoromethylpiperidine-HCl saltSBB091006AKOS005063309CS-W015928LF-0520
데이터베이스 식별자
- CAS
155849-49-3- PubChem CID
- 16218160
- DTXSID
DTXSID50584789- EC Number
- 625-412-3
물성
구조 계산 물성
- 극성 표면적
- 12 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 104
물리화학적 성질
- 녹는점
- 155 · 155-159 °C
- 끓는 점
- 134 ℃ · 134℃
- 저장 조건
- 2 · 2-8°C
- 물리적 상태
- 결정성 분말
- 색상
- 하얀색
- BRN
- 1341222 · 1341222
- InChI
- 1S/C6H10F3N.ClH/c7-6(8,9)5-1-3-10-4-2-5;/h5,10H,1-4H2;1H
- InChIKey
- KMUKXPQVPQUCDB-UHFFFAOYSA-N
- SMILES
- Cl.FC(F)(F)C1CCNCC1
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (97.9%): 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 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (97.9%)
안전 데이터
- wgk
- 3
- HS 번호
- 2933399990
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26
- 위험 등급
- IRRITANT, IRRITANT-HARMFUL
- 위험 참고 사항
- Irritant
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도4-(Trifluoromethyl)piperidine Hydrochloride is used in the preparation of adenosine receptor antagonists.
상·하류 제품 정보
상류 원료
공급사77 곳
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