3-エチルアミノ-4-メチルフェノール

3-Ethylamino-4-methylphenol

HCID 8428CAS 120-37-6

基本情報

標準SMILES
CCNc1cc(O)ccc1C
InChIKey
CTGSQPRDMHCIMM-UHFFFAOYSA-N
分子式
C9H13NO
平均分子量
151.21 g/mol
単同位体質量
151.09971404

概要

3-ethylamino-4-methylphenol is a purple solid. (NTP, 1992)

名称と識別子

優先名称
3-Ethylamino-4-methylphenol
IUPAC
3-(ethylamino)-4-methylphenol
現地名
3-エチルアミノ-4-メチルフェノール
英語名
3-Ethylamino-4-methylphenol
分子式
C9H13NO
分子量
151.21

名称と別名

120-37-63-(ethylamino)-4-methylphenol3-ETHYLAMINO-4-METHYLPHENOL3-Ethylamino-p-cresolPhenol, 3-(ethylamino)-4-methyl-3-(Ethylamino)-p-cresol3-Ethylamino-4-cresolCCRIS 4639DTXSID7025269EINECS 204-391-0BRN 32415488002QME89H
名称をさらに表示
3-エチルアミノ-4-メチルフェノール3-(エチルアミノ)-4-メチルフェノール3-エチルアミノ-p-クレゾール3-Ethylamino3-Ethylamino-4-kresol3-Ethylamino-p-cresol>3-ETHYLAMINO-4-METHYLPHENOL5-Ethylamino-p-cresol (OH=1)4-Methyl-3-ethylaminophenol.3-Ethylamino-p-cresol (OH=1)
4-Methyl-3-ethylaminophenolDTXCID3052691-13-00-00227 (Beilstein Handbook Reference)METHYL-N-ETHYLAMINO PHENOL, 4-RefChem:5014282-Ethylamino-4-hydroxytolueneP-CRESOL, 3-(ETHYLAMINO)-MFCD00002382

データベース識別子

CAS
120-37-6
PubChem CID
8428
DTXSID
DTXSID7025269
ChEMBL
CHEMBL1520783
UNII
8002QME89H
EC Number
204-391-0
Nikkaji
J27.387B

物性

構造計算による物性

XLogP
2.3
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
11

実験および物理化学的性質

Solubilityless than 0.1 mg/mL at 64 °F (NTP, 1992)
Physical Description3-ethylamino-4-methylphenol is a purple solid. (NTP, 1992)

物理化学的性質

融点
85 · 85-87 °C (lit.)
沸点
135 · 135-140°C 3mm
比重(密度)
1.0406 · 1.0406 (rough estimate)
屈折率
1.538 · 1.5380 (estimate)
闪点
135 · 135-140°C/3mm
貯蔵温度
Keep in dark place,Inert atmosphere,Room temperature

化学的性質

化学的特性purple solid

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory InformationChemical: Phenol, 3-(ethylamino)-4-methyl-
DOT LabelPoison
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Health HazardsExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1 件

An amine and phenol. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides. 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.

安全と保護具

Fire FightingFires involving this compound can be controlled with 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 ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 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 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.

Isolation and EvacuationExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
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

wgk
2
tsca
TSCA listed
rtecs
SL4105000
hs_code
29222990
risk_code
36/37/38
hazard_code
Xi

化学と産業

用途と製造

General Manufacturing InformationPhenol, 3-(ethylamino)-4-methyl-: ACTIVE

応用分野

使用3-Ethylamino-4-methylphenol was used in the synthesis of rhodol by undergoing condensation reaction with 2-(2,4-dihydroxybenzoyl)benzoic acid.

一般的な説明Purple solid.

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]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]

関連反応

3 件

関連ノート

読み込み中…