alpha-(4-Fluorophenyl)-4-(trifluoromethyl)benzenemethanol

HCID 579773CAS 39768-86-0

기본 정보

표준 SMILES: OC(c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1
InChIKey: XYMORTGEMACCDO-UHFFFAOYSA-N
분자식: C14H10F4O
평균 분자량: 270.22 g/mol
단동위원소 질량: 270.06677782

이름 및 식별자

우선 이름: alpha-(4-Fluorophenyl)-4-(trifluoromethyl)benzenemethanol
IUPAC: (4-fluorophenyl)-[4-(trifluoromethyl)phenyl]methanol

이름 및 동의어

39768-86-0alpha-(4-Fluorophenyl)-4-(trifluoromethyl)benzenemethanolDTXSID8012153174-FLUORO-4'-(TRIFLUOROMETHYL)BENZHYDROLRefChem:555261DTXCID501646660668-020-8(4-Fluorophenyl)[4-(trifluoromethyl)phenyl]methanol4'Trifluoromethylphenyl-4-fluorobenzhydrolSCHEMBL1350356MFCD00034183AKOS010332917

이름 더 보기

(4-Fluorophenyl) [4-(trifluoromethyl)phenyl]methanol(4-Fluorophenyl)[4-(trifluoromethyl)phenyl]methanol #a-(4-Fluorophenyl)-4-(trifluoromethyl)benzenemethanol|A-(4-Fluorophenyl)-4-(trifluoromethyl)benzenemethanolI+/--(4-Fluorophenyl)-4-(trifluoromethyl)benzenemethanolBenzenemethanol, alpha-(4-fluorophenyl)-4-(trifluoromethyl)-

데이터베이스 식별자

CAS: 39768-86-0
PubChem CID: 579773
DTXSID: DTXSID801215317
EC Number: 668-020-8

물성

구조 계산 물성

XLogP: 3.7
극성 표면적: 20.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 2
무거운 원자 수: 19
형식 전하: 0
복잡도: 276

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

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

P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.