2-アミノ-5-クロロフェノール

2-Amino-5-chlorophenol

HCID 91591CAS 28443-50-7
部分構造検索類似構造を探す

基本情報

標準SMILES
Nc1ccc(Cl)cc1O
InChIKey
FZCQMIRJCGWWCL-UHFFFAOYSA-N
分子式
C6H6ClNO
平均分子量
143.57 g/mol
単同位体質量
143.0137915

名称と識別子

優先名称
2-Amino-5-chlorophenol
IUPAC
2-amino-5-chlorophenol
現地名
2-アミノ-5-クロロフェノール
英語名
2-Amino-5-chlorophenol
分子式
C6H6ClNO
分子量
143.57

名称と別名

2-Amino-5-chlorophenol28443-50-74-chloro-2-hydroxyanilinePhenol, 2-amino-5-chloro-5-chloro-2-aminophenol6VK2H53LQNDTXSID6067385CHEBI:75051RefChem:85263DTXCID0037819249-020-3MFCD02093863
名称をさらに表示
2-アミノ-5-クロロフェノール2-ヒドロキシ-4-クロロアニリン5-クロロ-2-アミノフェノール2-アミノ-5-クロロフェノ-ルクロロ-アミノ-フェノール2‐アミノ‐5‐クロロフェノールTIMTEC-BB SBB0041372-Amino-5-chlorophenCyclohexane Impurity 1Lenvatinib Impurity 82Chlorzoxazone Impurity 242-Amino-5-chlorophenol 97%2-Amino-5-chlorophenol,99%
2-amino-5-chloro-phenolEINECS 249-020-35-chloro-o-aminophenol2-hydroxy-4-chloroanilineUNII-6VK2H53LQNEC 249-020-3SCHEMBL1033293-CHLORO-6-AMINOPHENOL

データベース識別子

CAS
28443-50-7
PubChem CID
91591
DTXSID
DTXSID6067385
ChEBI
CHEBI:75051
UNII
6VK2H53LQN
EC Number
249-020-3
Nikkaji
J88.559B

物性

構造計算による物性

XLogP
1.8
極性表面積
46.3 Ų
水素結合供与体数
2
水素結合受容体数
2
回転可能結合数
0
重原子数
9

物理化学的性質

融点
145 · 145-153 °C (lit.)
沸点
185.5 °C · 185.5°C (rough estimate)
比重(密度)
1.2028 · 1.2028 (rough estimate)
蒸気圧
0.002 · 0.002-0.094Pa at 20-50℃
屈折率
1.5618 · 1.5618 (estimate)
貯蔵温度
-20 °C, · -20°C, stored under nitrogen

化学的性質

化学的特性light brown fine crystalline powder

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (97.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (97.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (95.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 43 reports by companies from 6 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

Regulatory InformationStatus: Cease Manufacture Update: 19-02-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/12346
Hazard Classes and CategoriesSkin Irrit. 2 (97.7%)；Eye Irrit. 2 (97.7%)；STOT SE 3 (95.3%)

法規制情報

Regulatory InformationStatus: Cease Manufacture Update: 19-02-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/12346

安全データ

wgk
3
tsca
TSCA listed
hs_code
29222990
risk_code
36/37/38-20/21/22
化審法
(3)-906
hazard_code
Xi,Xn

化学と産業

用途と製造

General Manufacturing InformationPhenol, 2-amino-5-chloro-: ACTIVE
応用分野 · 2 件

使用2-Amino-5-chlorophenol may be used to synthesize 2-amino-5-chloromuconic semialdehyde and benzoxazole derivatives.

一般的な説明2-Amino-5-chlorophenol can be synthesized from 2-chloro-5-nitrophenol via reduction. It can also be obtained from 1-chloro-4-nitrobenzene by using a bacterial strain LW1. 2-Amino-5-chlorophenol participates in the condensation reaction with acetylferrocene to afford ferrocenyl Schiff bases bearing a phenol group.

上流・下流製品情報

サプライヤー50 社

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]
上海达立康医药科技有限公司18658316824
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
环生美森医药技术（山东）有限公司0531-88762217 18301471076 · [email protected]

補足説明

定義ChEBI: Phenol carrying amino and chloro substituents at positions 2 and 5 respectively. It is part of the degradation pathway of 4-chloronitrobenzene, CHEBI:34399.

関連反応

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