2-アミノ-4-クロロフェノール

2-アミノ-4-クロロフェノール · 2アミノ4クロロフェノ-ル · 2-アミノ-4-クロロフェノール塩化物 · 5-クロロ-2-ヒドロキシアニリン · 2 アミノ-4-クロロフェノール · 4-クロロ-2-アミノフェノール · 2-ヒドロキシ-5-クロロアニリン · C.I.オキシデーションベース18

https://huagongshe.com/ja/chemical/7265

識別子と物理属性

CAS No.	95-85-2
分子式	C6H6ClNO
平均分子量	143.57 g/mol
単同位体質量	143.01379149 g/mol
SMILES	Nc1cc(Cl)ccc1O
InChIKey	SWFNPENEBHAHEB-UHFFFAOYSA-N
PubChem CID	7265
ChEMBL	CHEMBL251389
EC No.	202-458-9
DTXSID	DTXSID5024473
現地名	2-アミノ-4-クロロフェノール

化学・物理的性質

XLogP	1.8
極性表面積	46.3
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
形式電荷	0
複雑度	99.1
物質分類	Nitrogen Compounds -> Amino Phenols
化粧品	Cosmetic ingredients (4-Chloro-2-Aminophenol) -> CIR (Cosmetic Ingredient Review)Hair dyeing
LogP（分配係数）	1.241.81
溶解度	less than 1 mg/mL at 68 °F (NTP, 1992)Solubility in water, g/l at 26 °C: 3 (slightly soluble)2.3g/リットル不溶。 <0.1 g/100 mL で 20 ºC
引火点	170 °C
Decomposition	170 °C
融点	284 to 286 °F (decomposes) (NTP, 1992)140 °C136-141 °C(lit.)
蒸気圧	0.00141 [mmHg]Vapor pressure, Pa at 25 °C: 0.2
Physical Description	2-Amino-4-chlorophenol is a light brown colored crystalline solid. It may be toxic by ingestion. It is insoluble in water. It is used to make other chemicals.Brown solid[ICSC] Brown powder[Alfa Aesar MSDS]BROWN CRYSTALLINE POWDER WITH CHARACTERISTIC ODOUR.
自然発火温度	500 °C
沸点	185.5°C (rough estimate)
密度	1.2028 (rough estimate)
屈折率	1.5618 (estimate)
貯蔵条件	2-8°C
pKa（酸解離定数）	9.31±0.18(Predicted)
外観・状態	個体
色	淡いオレンジ色から薄茶色
BRN	774859
安定性	安定。強力な酸化剤とは相容れない。
化粧品成分の機能	ヘアカラーリング
InChI	1S/C6H6ClNO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,8H2
InChIKey	SWFNPENEBHAHEB-UHFFFAOYSA-N
SMILES	Nc1cc(Cl)ccc1O
CAS データベース	95-85-2(CAS DataBase Reference)
NISTの化学物質情報	5-Chloro-2-hydroxyaniline(95-85-2)
EPAの化学物質情報	2-Amino-4-chlorophenol (95-85-2)

化学的特性

2-Amino-4-chlorophenol is a grayish to light brown crystalline solid or powder

安全性と法規制

GHS 分類	This chemical does not meet GHS hazard criteria for 15.5% (15 of 97) of reports.WarningH302 (84.5%): Harmful if swallowed [Warning Acute toxicity, oral]P203, P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 97 reports by companies from 12 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Danger
規制情報	Chemical: Phenol, 2-amino-4-chloro-Hazard Traits - CarcinogenicityStatus: Active Update: 23-11-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/102894-Chloro-2-aminophenol: Does not have an individual approval but may be used under an appropriate group standardThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
その他の安全情報	IMAP assessments - Phenol, 2-amino-4-chloro-: Environment tier I assessment
輸送ラベル（DOT）	Poison
火災危険	Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:· Non-combustible, substance itself does not burn but may decompose upon heating to produce corrosive and/or toxic fumes.Combustible. Gives off irritating or toxic fumes (or gases) in a fire.
健康有害性	Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:· Highly toxic, may be fatal if inhaled, ingested or absorbed through skin.
有害性の概要	Causes contact dermatitis. [ChemIDplus] May cause skin sensitization[ICSC] A skin, eye, and mucous membrane irritant[NTP] A skin and strong eye irritantMay induce methemoglobinemiaToxic by ingestion[Alfa Aesar MSDS]
輸送番号・ガイド（DOT）	2673 151

用途

染料中間体

用途

有機合成原料。

使用

Intermediate.

一般的な説明

5-Chloro-2-hydroxyaniline is a light brown colored crystalline solid. 5-Chloro-2-hydroxyaniline may be toxic by ingestion. 5-Chloro-2-hydroxyaniline is insoluble in water. 5-Chloro-2-hydroxyaniline is used to make other chemicals.