2-(트리플루오로메틸)페닐브로마이드

2-Bromo-1-[2-(trifluoromethyl)phenyl]ethan-1-one

HCID 2778430

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 54109-16-9
표준 SMILES: O=C(CBr)c1ccccc1C(F)(F)F
InChIKey: KWZCBMKXNYOQAK-UHFFFAOYSA-N
분자식: C9H6BrF3O
평균 분자량: 267.04 g/mol
단동위원소 질량: 265.95541157

이름 및 식별자

우선 이름: 2-Bromo-1-[2-(trifluoromethyl)phenyl]ethan-1-one
IUPAC: 2-bromo-1-[2-(trifluoromethyl)phenyl]ethanone
현지명: 2-(트리플루오로메틸)페닐브로마이드
영어명: 2-(TRIFLUOROMETHYL)PHENACYL BROMIDE
분자식: C9H6BrF3O
분자량: 267.04

이름 및 동의어

2-bromo-1-[2-(trifluoromethyl)phenyl]ethan-1-one2-bromo-1-(2-(trifluoromethyl)phenyl)ethan-1-oneRefChem:465869638-938-354109-16-92-(Trifluoromethyl)phenacyl bromide2-bromo-1-[2-(trifluoromethyl)phenyl]-1-ethanone2-Bromo-2'-(trifluoromethyl)acetophenone2-bromo-1-[2-(trifluoromethyl)phenyl]ethanoneMFCD030943042-bromo-1-(2-trifluoromethyl-phenyl)-ethanone2-BROMO-1-(2-(TRIFLUOROMETHYL)PHENYL)ETHANONE

이름 더 보기

2-(트리플루오로메틸)페닐브로마이드2-(trifluoromethtl)phenacyl bromide2'-(TRIFLUOROMETHYL)PHENACYL BROMIDE2-Bromo-2'-(trifluoromethyl)acetophenone >2-Bromo-2'-(trifluoromethyl)acetophenone,97%2-Bromo-1-[2-(trifluoromethyl)phenyl]-1-ethanone, 95+%

Ethanone, 2-bromo-1-[2-(trifluoromethyl)phenyl]-SCHEMBL1689792-trifluoromethyphenacyl bromide2-trifluoromethyl phenacylbromide2-trifluoromethylphenacyl bromideSCHEMBL30013031DTXSID50380925SBB018326

데이터베이스 식별자

CAS: 54109-16-9
PubChem CID: 2778430
DTXSID: DTXSID50380925
EC Number: 638-938-3
Nikkaji: J3.438.692G

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 14
형식 전하: 0
복잡도: 215

물리화학적 성질

녹는점: 28 · 28-30
끓는 점: 52 · 52/0.03mm
밀도: 1.592 · 1.592±0.06 g/cm3 (20 ºC 760 Torr)
인화점: 109.7 · 109.7±27.3℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: powder to lump to clear liquid
색상: White or Colorless to Light yellow to Light orange
수용성: 물에 약간 용해됩니다.

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H290 (12.5%): May be corrosive to metals [Warning Corrosive to Metals]

P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 8 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesMet. Corr. 1 (12.5%)

안전 데이터

ridadr: 1759
HS 번호: 2914790090
risk_code: 34
hazard_code: C
safety_code: 26-36/37/39-45
포장분류: III
위험 등급: IRRITANT
위험 참고 사항: Corrosive

화학 및 산업

응용 분야 · 1건

용도The sulfonyl urea thus obtained was used directly in the following condensation with 4-(trifluoromethyl)phenacyl bromide. Upon heating, benzenesulfinic acid ammonium salt might react with 2-(trifluoromethyl)phenacyl bromide to give β-keto sulfone. In Rap-Stoermer condensation reation.