4-Fluoro-N-methoxy-N-methylbenzamide

HCID 14069347

노트 반응

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기본 정보

CAS: 116332-54-8
표준 SMILES: CON(C)C(=O)c1ccc(F)cc1
InChIKey: DSUFRPVVBZLHPI-UHFFFAOYSA-N
분자식: C9H10FNO2
평균 분자량: 183.18 g/mol
단동위원소 질량: 183.06955678

이름 및 식별자

우선 이름: 4-Fluoro-N-methoxy-N-methylbenzamide
IUPAC: 4-fluoro-N-methoxy-N-methylbenzamide
영어명: 4-Fluoro-N-methoxy-N-methylbenzamide
분자식: C9H10FNO2
분자량: 183.18

이름 및 동의어

4-FLUORO-N-METHOXY-N-METHYLBENZAMIDE116332-54-8DTXSID00555388RefChem:98995DTXCID80506171820-825-7Benzamide, 4-fluoro-N-methoxy-N-methyl-MFCD02179265N-methoxy-N-methyl-4-fluorobenzamiden-methyl,n-methoxy-4-fluorobenzamiden-methyl-n-methoxy-4-fluorobenzamide4-fluoro-N-methoxy-N-methyl-benzamide

이름 더 보기

SKL799pFB-DMHHUORO-N-METHOXY-N-METHYL4-Fluoro-N-methyl-N-methoxybenzamideN-Methoxy-N-methyl-4-fluorobenzaldehyde4-Fluoro-N-methoxy-N-methylbenzamide 98%4-FLUORO-N-METHOXY-N-METHYLBENZAMIDE(WXFC0878)

GS-6370CS-0042878EN300-202846Z54739555A803598SCHEMBL3066004-Fluoro-N-methoxy-N-metylbenzamideAB9349

데이터베이스 식별자

CAS: 116332-54-8
PubChem CID: 14069347
DTXSID: DTXSID00555388
EC Number: 820-825-7
Nikkaji: J2.166.138D

물성

구조 계산 물성

XLogP: 1.5
극성 표면적: 29.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 178

물리화학적 성질

끓는 점: 301.6 · 301.6±25.0 °C(Predicted)
밀도: 1.179 · 1.179±0.06 g/cm3(Predicted)
굴절률: 1.51 · 1.51
저장 조건: Sealed in dry,Room Temperature
물리적 상태: 투명한 액체
색상: White to Yellow to Green
InChI: InChI=1S/C9H10FNO2/c1-11(13-2)9(12)7-3-5-8(10)6-4-7/h3-6H,1-2H3
InChIKey: DSUFRPVVBZLHPI-UHFFFAOYSA-N
SMILES: C(N(OC)C)(=O)C1=CC=C(F)C=C1

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (50%)

안전 데이터

HS 번호: 2928009090

화학 및 산업

응용 분야 · 1건

개요4-Fluoro-N-methoxy-N-methylbenzamide is a fluorinated aromatic. As an organofluorine compound, it can synthesise pyridyl heterocycles and photochromic compounds. 4-Fluoro-N-methoxy-N-methylbenzamide can form exocyclic fluorinating agents by reacting with iodides. It can form complexes with copper or zinc as a ligand and convert metal hydroxides into metal carbonyls as a carbonylative agent. As a phosphine, it can be converted into carboxylic acids through hydrolysis or oxidation.