2'-FLUORO-6'-메톡시아세토페논

2'-Fluoro-6'-methoxyacetophenone

HCID 2737355

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 120484-50-6
표준 SMILES: COc1cccc(F)c1C(C)=O
InChIKey: POHCKHGBDOTACV-UHFFFAOYSA-N
분자식: C9H9FO2
평균 분자량: 168.16 g/mol
단동위원소 질량: 168.05865769

이름 및 식별자

우선 이름: 2'-Fluoro-6'-methoxyacetophenone
IUPAC: 1-(2-fluoro-6-methoxyphenyl)ethanone
현지명: 2'-FLUORO-6'-메톡시아세토페논
영어명: 2'-FLUORO-6'-METHOXYACETOPHENONE
분자식: C9H9FO2
분자량: 168.16

이름 및 동의어

120484-50-62'-Fluoro-6'-methoxyacetophenoneDTXSID80372010RefChem:241162DTXCID40323043642-477-31-(2-fluoro-6-methoxyphenyl)ethanoneMFCD006717622-FLUORO-6-METHOXYACETOPHENONE1-(2-fluoro-6-methoxyphenyl)ethan-1-one1-(2-Fluoro-6-methoxy-phenyl)ethanoneEthanone, 1-(2-fluoro-6-methoxyphenyl)-

이름 더 보기

2'-FLUORO-6'-메톡시아세토페논2′-Fluoro-6′-methoxyacetophenone, CAS 120484-50-6

SCHEMBL1957640SCHEMBL30313283POHCKHGBDOTACV-UHFFFAOYSA-N1-acetyl-2-fluoro-6-methoxybenzeneCK2586SBB088157XH1023AKOS000221677

데이터베이스 식별자

CAS: 120484-50-6
PubChem CID: 2737355
DTXSID: DTXSID80372010
EC Number: 642-477-3

물성

구조 계산 물성

XLogP: 1.7
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 170

물리화학적 성질

끓는 점: 217 ℃ · 217℃
밀도: 1.127 · 1.127
굴절률: 1.508 · 1.508
인화점: 83 ℃ · 83℃
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 액체
색상: Clear, lemon/pale amber

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 7 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

안전 데이터

HS 번호: 2914790090
hazard_code: Xi
위험 참고 사항: Irritant

화학 및 산업

응용 분야

용도1-(2-Fluoro-6-methoxyphenyl)ethanone is a useful synthetic intermediate. It is used to prepare spiro[2H-1-benzopyran-2,4''-piperidine] derivatives as glycine transport inhibitors.