4-フェノキシアニリン

(4-Aminophenoxy)benzene

HCID 8764CAS 139-59-3

基本情報

標準SMILES
Nc1ccc(Oc2ccccc2)cc1
InChIKey
WOYZXEVUWXQVNV-UHFFFAOYSA-N
分子式
C12H11NO
平均分子量
185.22 g/mol
単同位体質量
185.08406397

名称と識別子

優先名称
(4-Aminophenoxy)benzene
IUPAC
4-phenoxyaniline
現地名
4-フェノキシアニリン
英語名
4-Phenoxyaniline
分子式
C12H11NO
分子量
185.22

名称と別名

4-PHENOXYANILINE139-59-34-Aminodiphenyl etherp-PhenoxyanilineBenzenamine, 4-phenoxy-Aniline, p-phenoxy-44P7PAW368NSC-4629DTXSID8059687(4-aminophenoxy)benzeneRefChem:518227DTXCID6034506
名称をさらに表示
4-フェノキシアニリン4-アミノフェニル(フェニル)エーテル4-アミノフェニルフェニルエーテルフェニル(4-アミノフェニル)エーテル4-フェノキシベンゼンアミン4-アミノジフェニルエーテル4‐フェノキシアニリン(1,1′-オキシビスベンゼン)-4-アミン3-Methyl-5-sulfanilamidoisothiazoleBidizoleAmidozoleNSC 139593AKOS B019893AKOS AUF020074-Phenoxanilinep-phenoxy-anilin
205-367-24-Phenoxybenzenamine4-Aminophenyl phenyl ether4-Amino-1-phenoxybenzene4-Aminodifenylether4-Aminobiphenyl ether4-Aminodiphenyletherp-Aminophenyl phenyl ether

データベース識別子

CAS
139-59-3
PubChem CID
8764
DTXSID
DTXSID8059687
ChEMBL
CHEMBL249550
UNII
44P7PAW368
EC Number
205-367-2
Nikkaji
J33.852D

物性

構造計算による物性

XLogP
2.9
極性表面積
35.3 Ų
水素結合供与体数
1
水素結合受容体数
2
回転可能結合数
2
重原子数
14

物理化学的性質

融点
82 · 82-84 °C(lit.)
沸点
140 °C · 140 °C (2.2503 mmHg)
比重(密度)
1.0936 · 1.0936 (rough estimate)
屈折率
1.53 · 1.5300 (estimate)
貯蔵温度
RT, protect from light
外見
結晶フレークまたは粉末

化学的性質

化学的特性brown to green-brown crystalline flakes or powder

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (89.6%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (97.9%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (89.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H341 (14.6%): Suspected of causing genetic defects [Warning Germ cell mutagenicity];H400 (12.5%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (12.5%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

P203, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 7 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.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%);Skin Irrit. 2 (89.6%);Skin Sens. 1 (97.9%);Eye Irrit. 2 (100%);STOT SE 3 (89.6%);Muta. 2 (14.6%);Aquatic Acute 1 (12.5%);Aquatic Chronic 1 (12.5%)

安全データ

F
9
wgk
3
tsca
TSCA listed
rtecs
BY7930000
毒性
skn-rbt 500 mg/24H MLD 28ZPAK -,119,72
hs_code
29222990

化学と産業

薬理情報

Metabolism/Metabolites4-phenoxyaniline has known human metabolites that include N-(4-Phenoxyphenyl)acetamide.

用途と製造

General Manufacturing InformationBenzenamine, 4-phenoxy-: ACTIVE

調製方法

純化方法Crystallise 4-phenoxyaniline from water. [Beilstein 13 IV 1020.]

サプライヤー50 社

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]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海凌凯科技股份有限公司58950110 13124863828 · [email protected]

関連反応

228 件

関連ノート

読み込み中…