1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene

HCID 4281885CAS 40230-93-1

기본 정보

표준 SMILES: C[Si](C)(C)C#Cc1cccc(C(F)(F)F)c1
InChIKey: LHWMUAXYSGPPIX-UHFFFAOYSA-N
분자식: C12H13F3Si
평균 분자량: 242.31 g/mol
단동위원소 질량: 242.07386161

이름 및 식별자

우선 이름: 1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene
IUPAC: trimethyl-[2-[3-(trifluoromethyl)phenyl]ethynyl]silane
영어명: 1-((Trimethylsilyl)ethynyl)-3-trifluoro&
분자식: C12H13F3Si
분자량: 242.31

이름 및 동의어

40230-93-11-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzeneTrimethyl-[2-[3-(trifluoromethyl)phenyl]ethynyl]silanetrimethyl((3-(trifluoromethyl)phenyl)ethynyl)silaneTrimethyl[[3-(trifluoromethyl)phenyl]ethynyl]silaneTrimethyl{[3-(trifluoromethyl)phenyl]ethynyl}silaneSCHEMBL1477351SCHEMBL28812482DTXSID40401537MFCD03701551AKOS015889146SY363751

이름 더 보기

1-((Trimethylsilyl)ethynyl)-3-trifluoro&TRIMETHYL-(3-TRIFLUOROMETHYL-PHENYLETHYNYL)-SILANE1-(Trifluoromethyl)-3-[2-(trimethylsilyl)ethynyl]benzene1-(3'-trifluoromethylphenyl)-2-(trimethylsilyl)acetylene1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene 98%1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene 98%Benzene, 1-(trifluoromethyl)-3-[2-(trimethylsilyl)ethynyl]-

Trimethyl-(3-trifluoromethylphenylethynyl)-silane1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene, 98%

데이터베이스 식별자

CAS: 40230-93-1
PubChem CID: 4281885
DTXSID: DTXSID40401537
Nikkaji: J559.019A

물성

구조 계산 물성

극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 16
형식 전하: 0
복잡도: 300

물리화학적 성질

끓는 점: 50 · 50-52 °C0.5 mm Hg(lit.)
밀도: 1.036 g/mL · 1.036 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.4760(lit.)
인화점: 185 °F · 185 °F
InChI: 1S/C12H13F3Si/c1-16(2,3)8-7-10-5-4-6-11(9-10)12(13,14)15/h4-6,9H,1-3H3
InChIKey: LHWMUAXYSGPPIX-UHFFFAOYSA-N
SMILES: C[Si](C)(C)C#Cc1cccc(c1)C(F)(F)F