2-アミノ-4-クロロフェノール

2-Amino-4-chlorophenol

HCID 7265CAS 95-85-2

基本情報

標準SMILES
Nc1cc(Cl)ccc1O
InChIKey
SWFNPENEBHAHEB-UHFFFAOYSA-N
分子式
C6H6ClNO
平均分子量
143.57 g/mol
単同位体質量
143.01379149

概要

2-Amino-4-Chlorophenol can cause cancer according to California Labor Code.

名称と識別子

優先名称
2-Amino-4-chlorophenol
IUPAC
2-amino-4-chlorophenol
現地名
2-アミノ-4-クロロフェノール
英語名
2-Amino-4-chlorophenol
分子式
C6H6ClNO
分子量
143.57

名称と別名

2-Amino-4-chlorophenol95-85-25-CHLORO-2-HYDROXYANILINE4-Chloro-2-aminophenolPhenol, 2-amino-4-chloro-Fouramine PY2-Hydroxy-5-chloroanilinep-Chloro-o-aminophenolC.I. Oxidation Base 18C.I. 76525DTXSID50244732Z43LEA3DX
名称をさらに表示
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18Chlorzoxazone Related CoMpound Ac.i.76525fouraminepy2-AMino-4-chloc.i.oxidationbase18TIMTEC-BB SBB007588
RODOL PYNSC-247814O-AMINO-P-CHLOROPHENOLDTXCID504473aminochlorophenolRefChem:85194202-458-92-amino-4-chloro-phenol

データベース識別子

CAS
95-85-2
PubChem CID
7265
DTXSID
DTXSID5024473
ChEMBL
CHEMBL251389
UNII
2Z43LEA3DX
EC Number
202-458-9
Nikkaji
J31.070K

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

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Amino Phenols
Cosmetics · 2 件

Cosmetic ingredients (4-Chloro-2-Aminophenol) -> CIR (Cosmetic Ingredient Review)

Hair dyeing

LogP · 2 件

1.24

1.81

Solubility · 2 件

less than 1 mg/mL at 68 °F (NTP, 1992)

Solubility in water, g/l at 26 °C: 3 (slightly soluble)

Flash Point170 °C
Decomposition170 °C

物理化学的性質

融点
136 · 136-141 °C(lit.)
沸点
185.5 °C · 185.5°C (rough estimate)
比重(密度)
1.2028 · 1.2028 (rough estimate)
屈折率
1.5618 · 1.5618 (estimate)
貯蔵温度
2 · 2-8°C
溶解性
2.3 g/リットル · 2.3g/リットル

化学的性質

化学的特性2-Amino-4-chlorophenol is a grayish to light brown crystalline solid or powder

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 15.5% (15 of 97) of reports.

Warning

H302 (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

危険有害性情報

Regulatory Information · 5 件

Chemical: Phenol, 2-amino-4-chloro-

Hazard Traits - Carcinogenicity

Status: Active Update: 23-11-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/10289

4-Chloro-2-aminophenol: Does not have an individual approval but may be used under an appropriate group standard

The 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.)

Other Safety InformationIMAP assessments - Phenol, 2-amino-4-chloro-: Environment tier I assessment
DOT LabelPoison
Fire Hazards · 3 件

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.

Health Hazards · 2 件

Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:

· Highly toxic, may be fatal if inhaled, ingested or absorbed through skin.

Hazards SummaryCauses contact dermatitis. [ChemIDplus] May cause skin sensitization; [ICSC] A skin, eye, and mucous membrane irritant; [NTP] A skin and strong eye irritant; May induce methemoglobinemia; Toxic by ingestion; [Alfa Aesar MSDS]

安全と保護具

Fire Fighting · 2 件

Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]:

Use water spray, foam, powder, carbon dioxide.

First Aid Measures · 4 件

Fresh air, rest. Seek medical attention if you feel unwell.

Wear protective gloves when administering first aid. Remove contaminated clothes. Rinse and then wash skin with water and soap.

Rinse with plenty of water for several minutes (remove contact lenses if easily possible).

Rinse mouth. Refer for medical attention .

Accidental Release Measures · 2 件

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· Do not touch damaged containers or spilled material unless wearing appropriate protective clothing.

First Aid · 2 件

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

General First Aid:

Safe StorageSeparated from oxidants and food and feedstuffs.
Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).

毒性情報

Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect
Exposure RoutesThe substance can be absorbed into the body by inhalation and by ingestion.
Toxicity Summary · 2 件

The CIR Expert Panel concludes that the available data support the safety of 6-Amino-m-Cresol, 4-Amino-m-Cresol, 5-Amino-4-Chloro-o-Cresol and 5-Amino-6-Chloro-o-Cresol as used in oxidative and nonoxidative (semipermanent) for dyes. The available data also support the safety of 6-Amino-o-Cresol and 4-Chloro-2-Aminophenol for use in oxidative hair dyes, but are insufficient to support the safety of 6-Amino-o-Cresol and 4-Chloro-2-Aminophenol and nonoxidative (semipermanent) hair dyes.

Safe for use in cosmetics, with qualifications

Signs and Symptoms · 3 件

See Effects of short-term exposure.

Redness.

Redness.

ICSC Environmental DataEnvironmental effects from the substance have not been investigated adequately.
Carcinogen Classification · 5 件

2-Amino-4-chlorophenol

Group 2B: Possibly carcinogenic to humans

Volume 123: (2020) Some Nitrobenzenes and Other Industrial Chemicals

2020 online

2018

安全データ

wgk
3
tsca
TSCA listed
rtecs
SJ5700000
ridadr
UN 2673
hs_code
29222900
risk_code
22-36/37/38-20/21/22

化学と産業

用途と製造

Uses · 2 件

CIR ingredient: 4-Chloro-2-Aminophenol

Used as an intermediate; [NTP]

Use ClassificationCosmetics -> Hair dyeing
General Manufacturing InformationPhenol, 2-amino-4-chloro-: ACTIVE
応用分野 · 4 件

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.

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関連反応

103 件

関連ノート

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