4-아이오딘아니솔

4-Iodoanisole

HCID 69676CAS 696-62-8

기본 정보

표준 SMILES
COc1ccc(I)cc1
InChIKey
SYSZENVIJHPFNL-UHFFFAOYSA-N
분자식
C7H7IO
평균 분자량
234.03 g/mol
단동위원소 질량
233.95416284

개요

(alpha-D-mannosyl)7-beta-D-mannosyl-diacetylchitobiosyl-L-asparagine, isoform B (protein) is a member of methoxybenzenes.

이름 및 식별자

우선 이름
4-Iodoanisole
IUPAC
1-iodo-4-methoxybenzene
현지명
4-아이오딘아니솔
영어명
4-Iodoanisole
분자식
C7H7IO
분자량
234.03

이름 및 동의어

4-Iodoanisole696-62-81-Iodo-4-methoxybenzenep-IodoanisoleBenzene, 1-iodo-4-methoxy-IsoformNSC-60727ZN7Y5PP2KWDTXSID7061015RefChem:524236DTXCID8046533211-798-7
이름 더 보기
4-아이오딘아니솔p-iodoanisol4-IODOANISOL4-IODANISOLE4-lodoanisole1-iodo-4-methoxy-benzenCREM-α
4-Methoxyiodobenzenep-MethoxyiodobenzeneAnisole, p-iodo-4-Iodomethoxybenzenep-Iodophenyl methyl ether1-iodo-4-methoxy-BenzeneMFCD00001056Izoform

데이터베이스 식별자

CAS
696-62-8
PubChem CID
69676
DTXSID
DTXSID7061015
ChEBI
CHEBI:174192
UNII
ZN7Y5PP2KW
EC Number
211-798-7
Nikkaji
J93.739H

물성

구조 계산 물성

XLogP
2.9
극성 표면적
9.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
1
무거운 원자 수
9

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Halogenated Anisoles
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physical DescriptionPale yellow powder; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
50 · 50-53 °C(lit.)
끓는 점
237 °C726 · 237 °C726 mm Hg(lit.)
밀도
1.7904 · 1.7904 (estimate)
인화점
230 °F · >230 °F
저장 조건
Keep in dark place,Sealed in dry,Room Temperature
용해도
에탄올, 에테르, 클로로포름에 용해됩니다.

화학적 성질

off-white to brown crystalline powder and chunks. Melting point 51-52 ℃, boiling point 237 ℃ (96.8kPa). Soluble in organic solvents such as alcohol and ether, but insoluble in water. Iodine can be easily separated and analyzed by light.

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 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationBenzene, 1-iodo-4-methoxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazards SummaryA skin and strong eye irritant; [Alfa Aesar MSDS]
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,Xn
safety_code
26-36-24/25

화학 및 산업

용도 및 제조

General Manufacturing InformationBenzene, 1-iodo-4-methoxy-: ACTIVE
응용 분야 · 1건

용도4-Iodoanisole is used in wide range of medicals industrial applications as well as in human and animal nutrition products, pharmaceutical intermediates, polarizing films for Liquid Crystal Display (LCD) chemicals. Iodine derivatives are also used as organic building blocks, analytical reagents.

제조 방법 · 1건

4-Iodoanisole is synthesized by the reaction of anisole with iodine chloride. Add anisole to glacial acetic acid, stir and slowly add iodine chloride. After the addition was completed, the temperature was refluxed for 3.5h. Cool, pour into ice water, and precipitate p-iodoanisole. After it was separated, the free iodine was washed with 5% sodium sulfite, then washed with water, distilled under reduced pressure, and the fractions with a boiling point of 140-160 °C (5.33 kPa) were collected and cooled to 0 °C for filtration. Wash with methanol and recrystallize to obtain the finished product.

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]
INTATRADE GmbH+49 3493/605464 · [email protected]

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