2-플루오로-5-(메틸술포닐)아닐린

2-Fluoro-5-(methylsulfonyl)aniline

HCID 2774637

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 387358-51-2
표준 SMILES: CS(=O)(=O)c1ccc(F)c(N)c1
InChIKey: NUBPBOIRQMDMNG-UHFFFAOYSA-N
분자식: C7H8FNO2S
평균 분자량: 189.21 g/mol
단동위원소 질량: 189.02597772

이름 및 식별자

우선 이름: 2-Fluoro-5-(methylsulfonyl)aniline
IUPAC: 2-fluoro-5-methylsulfonylaniline
현지명: 2-플루오로-5-(메틸술포닐)아닐린
영어명: 2-Fluoro-5-(methylsulfonyl)aniline
분자식: C7H8FNO2S
분자량: 189.21

이름 및 동의어

2-fluoro-5-(methylsulfonyl)aniline387358-51-2RefChem:472448671-145-02-fluoro-5-methylsulfonylaniline2-fluoro-5-methanesulfonylaniline2-fluoro-5-(methylsulphonyl)anilineMFCD019413142-fluoro-5-(methylsulfonyl)phenylamineSCHEMBL13710082-fluoro-5-methylsulphonylanilineDTXSID00960135

이름 더 보기

2-플루오로-5-(메틸술포닐)아닐린Benzenamine,2-fluoro-5-(methylsulfonyl)-

2-fluoro-5-methylsulfonyl-anilineNUBPBOIRQMDMNG-UHFFFAOYSA-N2-Fluoro-5-methylsulfonylphenylamine2-Fluoro-5-(methanesulfonyl)aniline2-fluoro-5-methanesulfonylphenylamineSBB090936AKOS0001179013-Amino-4-fluorophenyl methyl sulphone

데이터베이스 식별자

CAS: 387358-51-2、395090-68-3
PubChem CID: 2774637
DTXSID: DTXSID00960135
EC Number: 671-145-0

물성

구조 계산 물성

XLogP: 0.7
극성 표면적: 68.5 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 12
형식 전하: 0
복잡도: 247

물리화학적 성질

녹는점: 70 · 70~72℃
물리적 상태: 고체
색상: 하얀색

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (33.3%): 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.