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N-(p-ヒドロキシフェニル)-2-ナフタレンアミン

4-(2-Naphthylamino)phenol

HCID 7141
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
93-45-8
標準SMILES
Oc1ccc(Nc2ccc3ccccc3c2)cc1
InChIKey
RACMGQBQYYWANW-UHFFFAOYSA-N
分子式
C16H13NO
平均分子量
235.28 g/mol
単同位体質量
235.09971404

概要

4-(2-naphthylamino)phenol is a purple solid. (NTP, 1992)

名称と識別子

優先名称
4-(2-Naphthylamino)phenol
IUPAC
4-(naphthalen-2-ylamino)phenol
現地名
N-(p-ヒドロキシフェニル)-2-ナフタレンアミン
英語名
N-(4-Hydroxyphenyl)-2-naphthylamine, 97
分子式
C16H13NO
分子量
235.28

名称と別名

4-(2-NAPHTHYLAMINO)PHENOLp-OxinozonPhenol, 4-(2-naphthalenylamino)-p-(2-Naphthylamino)phenol4-(2-Naphthalenylamino)phenolCCRIS 6073N-p-Hydroxyphenyl-2-naphthylamineN-p-Hydroxyphenyl-beta-naphthylamineEINECS 202-248-7BRN 1642793PARAOXYNEOZONE391R4KT1XJ
名称をさらに表示
p-オキシノゾン4-(2-ナフチルアミノ)フェノールN-(p-ヒドロキシフェニル)-2-ナフタレンアミンN-(4’-ヒドロキシフェニル)-2-アミノナフタレン4-[(ナフタレン-2-イル)アミノ]フェノールp-Oxyneozonep-HydroxyneozonParaoxyneozone.p-HydroxyneozoneC.I.Sulphur Black 6Sulphur Vat Black CLG4-(2-Naftylamino)fenol4-(2-Naphtylamino)phenol
NSC-15372NSC-21065UNII-391R4KT1XJDTXSID8025701Phenol, 4-(2-naphthylamino)-3-13-00-01031 (Beilstein Handbook Reference)NAPHTHYLAMINO)PHENOL, 4-(2-RefChem:97073

データベース識別子

CAS
93-45-8
PubChem CID
7141
DTXSID
DTXSID8025701
ChEMBL
CHEMBL1699265
UNII
391R4KT1XJ
EC Number
202-248-7
Nikkaji
J39.595A

物性

構造計算による物性

XLogP
4.2
極性表面積
32.3 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
2
重原子数
18
形式電荷
0
複雑度
260

実験および物理化学的性質

Solubilityless than 1 mg/mL at 72 °F (NTP, 1992)
Physical Description4-(2-naphthylamino)phenol is a purple solid. (NTP, 1992)

物理化学的性質

融点
139 · 139-142 °C(lit.)
沸点
377.68 °C · 377.68°C (rough estimate)
比重(密度)
1.0711 · 1.0711 (rough estimate)
屈折率
1.6 · 1.6000 (estimate)
酸解離定数(Pka)
10.74 · 10.74±0.26(Predicted)
安定性
安定。強力な酸化剤とは相容れない。
EPAの化学物質情報
p-(2-Naphthylamino)phenol (93-45-8)

化学的性質

化学的特性purple solid

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 4 件

Warning

H312 (97.4%): Harmful in contact with skin [Warning Acute toxicity, dermal]

P203, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P317, P318, 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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Fire HazardsFlash point data for this compound are not available, however, it is probably combustible. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes. (NTP, 1992)
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1 件

Phenols do not behave as organic alcohols, as one might guess from the presence of a hydroxyl (-OH) group in their structure. Instead, they react as weak organic acids. Phenols and cresols are much weaker as acids than common carboxylic acids (phenol has pKa = 9.88). These materials are incompatible with strong reducing substances such as hydrides, nitrides, alkali metals, and sulfides. Flammable gas (H2) is often generated, and the heat of the reaction may ignite the gas. Heat is also generated by the acid-base reaction between phenols and bases. Such heating may initiate polymerization of the organic compound. Phenols are sulfonated very readily (for example, by concentrated sulfuric acid at room temperature). The reactions generate heat. Phenols are also nitrated very rapidly, even by dilute nitric acid.

Air and Water ReactionsThis chemical may be sensitive to prolonged exposure to air. Insoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (97.4%)

安全と保護具

Fire FightingFires involving this compound can be controlled using a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 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.

Nonfire Spill Response · 1 件

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Personal Protective Equipment (PPE) · 1 件

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

安全データ

tsca
TSCA listed
rtecs
SM1750000
risk_code
20/21/22-36/37/38-40
hazard_code
Xn
safety_code
26-36/37/39-45

化学と産業

用途と製造

General Manufacturing InformationPhenol, 4-(2-naphthalenylamino)-: INACTIVE

応用分野

一般的な説明Purple solid.

上流・下流製品情報

上流原料

4-アミノフェノール

サプライヤー23 社

湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
上海永叶生物科技有限公司86-021-61559134 15921386130 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
上海孚一生物科技有限公司+86 (21) 61124340
Alfa Chemistry1-516-6625404 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
郑州艾克姆化工有限公司0371-0371-55629727 13323845623 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
南京克罗托鲁宁医药科技有限公司13382066392
海蔚化学86-21-51086038 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
张家口艾科精细化工有限责任公司86-10-62944695-809 · [email protected]
Coresyn Pharmatech Co., Ltd.+86-571-86626709 +86-18157142896 · [email protected]
广州市禄涞医药科技有限公司13660253774 · [email protected]
青州达丰进出口有限公司16773308882 · [email protected]

関連反応

3 件
反応記録を作成
HRID 1165490 の反応式
HRID 1165490生成物としてuspto-grants-1990_03
HRID 1194498 の反応式
HRID 1194498生成物としてuspto-grants-1989_03
HRID 1557261 の反応式
HRID 1557261生成物としてTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

化合物ノート

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