o-Iodoanisole (HCID 68257)

개요

1-iodo-2-methoxybenzene is an organoiodine compound that is iodobenzene substituted by methoxy group at psotion 2. It is an aromatic ether and an organoiodine compound.

이름 및 식별자

우선 이름: o-Iodoanisole
IUPAC: 1-iodo-2-methoxybenzene
영어명: 2-Iodoanisole
분자식: C7H7IO
분자량: 234.03

이름 및 동의어

2-Iodoanisole1-Iodo-2-methoxybenzene529-28-2o-IodoanisoleBenzene, 1-iodo-2-methoxy-2-Methoxyiodobenzeneo-Anisyl iodideAnisole, o-iodo-2-Iodophenyl methyl ethero-methoxyiodobenzene2-METHOXYPHENYL IODIDE2-METHOXY-1-IODOBENZENE

이름 더 보기

Iodanisol2-Iodoanisole97%2-Iodoanisole 97%2-Iodoanisole,99%

NSC 9259NSC-9259EINECS 208-456-4O-IODOMETHOXYBENZENE75Y5532R8OO-IODOANISOLE [MI]O-METHOXYPHENYL IODIDEDTXSID1060184

데이터베이스 식별자

CAS: 529-28-2
PubChem CID: 68257
DTXSID: DTXSID1060184
ChEBI: CHEBI:16355
UNII: 75Y5532R8O
EC Number: 208-456-4
Nikkaji: J96.172H

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 85

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Halogenated Anisoles

SpringerMaterials Properties13C nuclear magnetic resonance spectrum

Physical DescriptionYellow liquid; Darkened by light exposure; [Merck Index] Clear light yellow liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점: 588.5 °C · 588.5 °C
끓는 점: 125 · 125-126 °C19 mm Hg(lit.)
밀도: 1.799 g/mL · 1.799 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.622(lit.)
인화점: 110 °C · >110°C
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
용해도: 알코올: 혼화성(lit.)
물리적 상태: 액체
Specific Gravity: 1.799 · 1.799
색상: 맑은 노란색
수용성: 불용성
Merck: 14 · 14,5028
BRN: 1860243 · 1860243
InChI: 1S/C7H7IO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChIKey: DVQWNQBEUKXONL-UHFFFAOYSA-N
SMILES: COc1ccccc1I
NIST: 2 · 2-Iodoanisole(529-28-2)
EPA: 1 · Benzene, 1-iodo-2-methoxy- (529-28-2)

화학적 성질

Clear yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazards SummaryA skin and strong eye irritant; [Sigma-Aldrich MSDS] See Anisole.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 29093090
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
기존화학 물질: KE-05-0754
F 고인화성물질: 8
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzene, 1-iodo-2-methoxy-: INACTIVE

응용 분야

용도2-Iodoanisole has been used in palladium/copper-catalyzed synthesis of o-(1-alkynyl)anisoles.

일반 설명2-Iodoanisole participates in palladium catalyzed enantioselective Heck arylation of 2,3-dihydrofuran in the presence of chiral ionic liquids containing L-prolinate and L-lactate anions and non-chiral quaternary ammonium cations.

상·하류 제품 정보

하류 제품

에틸렌3-METHOXYPHENYLACETATE Dibenzofuran, 1-nitro-2,2'-Dimethoxybiphenyl 2-Methoxybiphenyl 2-(2-메톡시페닐)-4,4,5,5-테트라메틸-1,3,2-디옥사보롤란 2,6-Dimethylanisole 3-Iodo-4-methoxyaniline 3-(2-METHOXY-PHENYL)-프로피온알데히드 N-(2-메톡시페닐)-4-메틸벤자미드 (4R)-3-(2-chloroethyl)-1-(4-methoxyphenyl)-4-phenylazetidin-2-one 3-(2-메톡시페닐)프로피오페논 N-(2-메톡시페닐)니코틴아미드

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]

추가 설명

정의ChEBI: An organoiodine compound that is iodobenzene substituted by methoxy group at psotion 2.

연결된 노트

불러오는 중…

o-Iodoanisole

기본 정보

개요