플루오로메틸페닐황화물

Fluoromethyl phenyl sulfide

HCID 5314298

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 60839-94-3
표준 SMILES: FCSc1ccccc1
InChIKey: ZDJQWFUQFDIBLS-UHFFFAOYSA-N
분자식: C7H7FS
평균 분자량: 142.2 g/mol
단동위원소 질량: 142.02524944

이름 및 식별자

우선 이름: Fluoromethyl phenyl sulfide
IUPAC: fluoromethylsulfanylbenzene
현지명: 플루오로메틸페닐황화물
영어명: Fluoromethylphenylsulfide
분자식: C7H7FS
분자량: 142.19

이름 및 동의어

60839-94-3FluoromethylphenylsulfidefluoromethylsulfanylbenzeneFLUOROMETHYL PHENYL SULFIDE(fluoromethyl)(phenyl)sulfane[(fluoromethyl)sulfanyl]benzenefluoromethylphenyl sulfideghl.PD_Mitscher_leg0.352Fluoromethylsulfanyl-benzenefluoromethyl phenyl sulphidefluoro-methylsulfanyl-benzeneSCHEMBL775769

이름 더 보기

플루오로메틸페닐황화물fluoromethylsulfanylbenzeBenzene, [(fluoromethyl)thio]-

SCHEMBL1031599SCHEMBL1982483SCHEMBL3612916SCHEMBL6971763DTXSID10415646ZDJQWFUQFDIBLS-UHFFFAOYSA-NDB-297612

데이터베이스 식별자

CAS: 60839-94-3
PubChem CID: 5314298
DTXSID: DTXSID10415646
Nikkaji: J441.135H

물성

구조 계산 물성

XLogP: 3.3
극성 표면적: 25.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 9
형식 전하: 0
복잡도: 69.3

실험 및 물리화학적 성질

SpringerMaterials Properties19F nuclear magnetic resonance spectrum

화학 및 산업

응용 분야

용도Fluoromethylphenylsulfide is used for synthesis of α-fluoro substituted sulfoxides and sulfones.

제조 방법

Fluoromethylphenylsulfide can be prepared by reaction of methyl phenyl sulfoxide with N,N-Diethylaminosulfur Trifluoride (F3SNEt2, DAST) (fig 2), or with DAST and Antimony(III) Chloride (fig 3).