1-[3-클로로-5-트리플루오로메틸페닐]-2,2,2-트리플루오로에타논

1-[3-Chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone

HCID 53414982

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1125812-58-9
표준 SMILES: O=C(c1cc(Cl)cc(C(F)(F)F)c1)C(F)(F)F
InChIKey: KPHAJQJWTSUTQU-UHFFFAOYSA-N
분자식: C9H3ClF6O
평균 분자량: 276.56 g/mol
단동위원소 질량: 275.9776614

이름 및 식별자

우선 이름: 1-[3-Chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone
IUPAC: 1-[3-chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone
현지명: 1-[3-클로로-5-트리플루오로메틸페닐]-2,2,2-트리플루오로에타논
영어명: 1-[3-Chloro-5-trifluoromethylphenyl]-2,2,2-trifluoroethanone
분자식: C9H3ClF6O
분자량: 276.56

이름 및 동의어

1125812-58-91-(3-chloro-5-(trifluoromethyl)phenyl)-2,2,2-trifluoroethanone1-[3-chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanoneEC 808-269-3RefChem:74296808-269-31-[3-CHLORO-5-TRIFLUOROMETHYLPHENYL]-2,2,2-TRIFLUOROETHANONEMFCD194409601-[3-chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoro-ethanone3'-Chloro-5'-trifluoromethyl-2,2,2-trifluoroacetophenoneDTXSID40696901AKOS016012362

이름 더 보기

1-[3-클로로-5-트리플루오로메틸페닐]-2,2,2-트리플루오로에타논afoxolaner-002afoxolaner Impurity 61-[3-Chloro-5-trifluoromethylphenyl2,2,2-trifluoro-3'-chloro-5'-trifluoromethylacetophenone3'-Chloro-5'-trifluoromethoxy-2,2,2-trifluoroacetophenone1-[3-Chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroketoneEthanone, 1-[3-chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoro-

1-(3-CHLORO-5-TRIFLUOROMETHYLPHENYL)-2,2,2-TRIFLUOROETHANONE1-[3-Chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethan-1-oneEN300-19389911-(3-chloro-5-(trifluoromethyl)phenyl)-2,2,2-trifluoroethan-1-one1-[3-Chloro-5-(SCHEMBL980627WLZ3525AS-75830

데이터베이스 식별자

CAS: 1125812-58-9
PubChem CID: 53414982
DTXSID: DTXSID40696901
EC Number: 808-269-3

물성

구조 계산 물성

XLogP: 4.2
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 7
회전 가능 결합 수: 1
무거운 원자 수: 17
형식 전하: 0
복잡도: 297

실험 및 물리화학적 성질

PFASPFAS -> PFAS identified in REACH Regulation EC No. 1272/2008

물리화학적 성질

끓는 점: 203 ℃ · 203℃
밀도: 1.512 · 1.512
인화점: 77 ℃ · 77℃
저장 조건: 2 · 2-8°C
InChI: InChI=1S/C9H3ClF6O/c10-6-2-4(7(17)9(14,15)16)1-5(3-6)8(11,12)13/h1-3H
InChIKey: KPHAJQJWTSUTQU-UHFFFAOYSA-N
SMILES: C(=O)(C1=CC(C(F)(F)F)=CC(Cl)=C1)C(F)(F)F

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationREACH registered substance: 1-[3-chloro-5-(trifluoromethyl)phenyl]-2,2,2-trifluoroethanone (EC: 808-269-3)

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

신호 어: Danger
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

응용 분야

용도1-[3-Chloro-5-trifluoromethylphenyl]-2,2,2-trifluoroethanone can be used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical production process.

상·하류 제품 정보

상류 원료

공급사100 곳

山东玖玥生物科技有限公司15553333686

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

上海策嵘生物科技有限公司[email protected]

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]

武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]

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