4-(트리플루오로메틸)페닐히드라진
4-(Trifluoromethyl)phenylhydrazine
기본 정보
- CAS
368-90-1- 표준 SMILES
NNc1ccc(C(F)(F)F)cc1- InChIKey
DBNLGTYGKCMLLR-UHFFFAOYSA-N- 분자식
- C7H7F3N2
- 평균 분자량
- 176.14 g/mol
- 단동위원소 질량
- 176.05613288
이름 및 식별자
- 우선 이름
- 4-(Trifluoromethyl)phenylhydrazine
- IUPAC
- [4-(trifluoromethyl)phenyl]hydrazine
- 현지명
- 4-(트리플루오로메틸)페닐히드라진
- 영어명
- 4-(Trifluoromethyl)phenylhydrazine
- 분자식
- C7H7F3N2
- 분자량
- 176.14
이름 및 동의어
4-(Trifluoromethyl)phenylhydrazine368-90-14-trifluoromethylphenylhydrazineDTXSID40190277RefChem:517171DTXCID50112768609-305-9(4-(Trifluoromethyl)phenyl)hydrazine[4-(trifluoromethyl)phenyl]hydrazine4-(trifluoromethyl)phenyl hydrazineMFCD00042508p-Trifluoromethylphenylhydrazine
이름 더 보기
4-(트리플루오로메틸)페닐히드라진4-(트라이플루오로메틸)페닐하이드라진BUTTPARK 44\57-164-(Trifluromethyl)phenylhydrà,à,à-trifluoro-p-tolylhydrazineP-(TRIFLUOROMETHYL)PHENYLHYDRAZINE4-(Trifluoromethyl)phenylhydrazine97%4-(Trifluoromethyl)phenylhydrazine,96%1-[4-(trifluoromethyl)phenyl]hydrazine4-(Trifluoromethyl)phenylhydrazine,95%4-(Trifluoromethyl)phenylhydrazine 97%
Hydrazine, [4-(trifluoromethyl)phenyl]-4-trifluoromethyl-phenylhydrazine(4-trifluoromethyl-phenyl)-hydrazineSTK500360GS-3179AC-149144-Hydrazinobenzotrifluoride4-(Trifluoromethyl)-phenylhydrazine
데이터베이스 식별자
- CAS
368-90-1- PubChem CID
- 136200
- DTXSID
DTXSID40190277- EC Number
- 609-305-9
- Nikkaji
- J308.981I
물성
구조 계산 물성
- XLogP
- 2.4
- 극성 표면적
- 38.1 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 138
물리화학적 성질
- 녹는점
- 63 · 63-65 °C (lit.)
- 끓는 점
- 118 · 118-122 °C/17 mmHg (lit.)
- 밀도
- 1.2773 · 1.2773 (estimate)
- 인화점
- 119 · 119-121°C/17mm
- 저장 조건
- 2 · 2-8°C
- 산도 계수 (pKa)
- 4.49 · 4.49±0.20(Predicted)
- 물리적 상태
- 가루
- 색상
- 노란색에서 갈색으로
- 수용성
- 물에 불용성.
- BRN
- 743759 · 743759
- InChI
- 1S/C7H7F3N2/c8-7(9,10)5-1-3-6(12-11)4-2-5/h1-4,12H,11H2
- InChIKey
- DBNLGTYGKCMLLR-UHFFFAOYSA-N
- SMILES
- NNc1ccc(cc1)C(F)(F)F
화학적 성질
Yellow to brownish powder
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (14.9%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (14.9%)
안전 데이터
- wgk
- 3
- ridadr
- 2811
- HS 번호
- 29280000
- risk_code
- 36/37/38-20/21/22
- hazard_code
- Xi,T,Xn
- safety_code
- 26-36-24/25
- 포장분류
- III
- 위험 등급
- IRRITANT, TOXIC
- 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)phenylhydrazine is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff.
일반 설명4-(Trifluoromethyl)phenylhydrazine participates as phenylhydrazine-based reductant containing fluorine atoms in the one-step reduction and functionalization of graphene oxide.
관련 반응
31건
화합물 노트
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