4-(4-트리플루오로메틸페녹시)아닐린

4-(4-(Trifluoromethyl)phenoxy)aniline

HCID 2760751

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 57478-19-0
표준 SMILES: Nc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1
InChIKey: SMLYUHJGJWSUEC-UHFFFAOYSA-N
분자식: C13H10F3NO
평균 분자량: 253.22 g/mol
단동위원소 질량: 253.0714486

이름 및 식별자

우선 이름: 4-(4-(Trifluoromethyl)phenoxy)aniline
IUPAC: 4-[4-(trifluoromethyl)phenoxy]aniline
현지명: 4-(4-트리플루오로메틸페녹시)아닐린
영어명: 4-(4-TRIFLUOROMETHYLPHENOXY)ANILINE
분자식: C13H10F3NO
분자량: 253.22

이름 및 동의어

4-(4-(Trifluoromethyl)phenoxy)aniline57478-19-04-[4-(trifluoromethyl)phenoxy]anilineDTXSID10375337RefChem:287818DTXCID30326366672-230-54-(4-Trifluoromethylphenoxy)anilineMFCD001709304-(4'-trifluoromethylphenoxy)aniline4-(4-trifluoromethyl-phenoxy)-phenylamineBenzenamine, 4-[4-(trifluoromethyl)phenoxy]-

이름 더 보기

4-(4-트리플루오로메틸페녹시)아닐린4-(4-Ttifluoromethylphenoxy)aniline4-[(4-Trifluoromethylphenyl)oxy]aniline4-(4-trifluoromethylphenoxy)benzeneamine4-[4-(Trifluoromethyl)phenoxy]benzenamine[4-[(4-Trifluoromethylphenyl)oxy]phenyl]amine

SCHEMBL473537p-(4-trifluoromethylphenoxy)-anilineSBB0620194-(4-trifluoromethylphenoxy) anilineAKOS009301207CS-W021992EBC-521897MS-9196

데이터베이스 식별자

CAS: 57478-19-0
PubChem CID: 2760751
DTXSID: DTXSID10375337
EC Number: 672-230-5
Nikkaji: J2.315.081F

물성

구조 계산 물성

XLogP: 3.9
극성 표면적: 35.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 2
무거운 원자 수: 18
형식 전하: 0
복잡도: 253

물리화학적 성질

녹는점: 70 · 70-80℃
끓는 점: 326 ℃ · 326℃
밀도: 1.293 · 1.293
인화점: 151 ℃ · 151℃
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
물리적 상태: 고체
산도 계수 (pKa): 4.41 · 4.41±0.10(Predicted)
색상: 베이지색

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302+H312+H332 (96.7%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 30 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.