ホームMCPワークベンチSkills
ホームワークベンチ通知マイページ
化工社オープンプロジェクト:[email protected]AIアクセス:llms.txt · MCPガイドプライバシーポリシー · 利用規約 · サポートv1.7.8
  1. ホーム
  2. /化合物

3'-アミノ-4'-エトキシアセトアニリド

N-(3-amino-4-ethoxyphenyl)acetamide

HCID 28207
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
部分構造検索類似構造を探す

基本情報

CAS
17026-81-2
標準SMILES
CCOc1ccc(NC(C)=O)cc1N
InChIKey
XTXFAVHDQCHWCS-UHFFFAOYSA-N
分子式
C10H14N2O2
平均分子量
194.23 g/mol
単同位体質量
194.10552769

概要

3-amino-4-ethoxyacetanilide is a brown powder. (NTP, 1992)

名称と識別子

優先名称
N-(3-amino-4-ethoxyphenyl)acetamide
IUPAC
N-(3-amino-4-ethoxyphenyl)acetamide
現地名
3'-アミノ-4'-エトキシアセトアニリド
英語名
N-(3-amino-4-ethoxyphenyl)acetamide
分子式
C10H14N2O2
分子量
194.23

名称と別名

N-(3-AMINO-4-ETHOXYPHENYL)ACETAMIDE3-Amino-4-ethoxyacetanilideCCRIS 29DTXSID7020053HSDB 5070Acetamide, N-(3-amino-4-ethoxyphenyl)-2-Amino-4-acetaminifenetol2-Amino-4-acetaminifenetol [Czech]EINECS 241-100-6UNII-8W076B0J2D3-Amino-4-ethoxyanilid kyseliny octove [Czech]BRN 3545784
名称をさらに表示
4'-エトキシ-3'-アミノアセトアニリド3'-アミノ-4'-エトキシアセトアニリド1-アセチルアミノ-4-エトキシ-3-アミノベンゼン4′-エトキシ-3′-アミノアセトアニリド3′-アミノ-4′-エトキシアセトアニリドN-(3-アミノ-4-エトキシフェニル)アセトアミドNCI-C01887Ncgc00090849-01AMINOETHOXYACETANILIDE4'-Ethoxy-3'-aminoacetanilide1-Acetylamino-4-ethoxy-3-aminobenzene
8W076B0J2D3'-AMINO-P-ACETOPHENETIDIDE3-Amino-4-ethoxyanilid kyseliny octoveDTXCID1053N-(3-AMINO-4-ETHOXYPHENYL)ACETAMIDE [HSDB]2-AMINO-4-ACETAMINIFENETOL (CZECH)3'-Amino-4'-Ethoxyacetanilide2Amino4acetaminifenetol

物性

構造計算による物性

XLogP
0.7
極性表面積
64.4 Ų
水素結合供与体数
2
水素結合受容体数
3
回転可能結合数
3
重原子数
14
形式電荷
0
複雑度
197

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Other Aromatics (Nitrogen)
Solubilityless than 0.1 mg/mL at 70 °F (NTP, 1992)
Flash Point40 °C
Melting Point257 to 261 °F (NTP, 1992)
Physical Description · 2 件

3-amino-4-ethoxyacetanilide is a brown powder. (NTP, 1992)

Brown solid; [CAMEO]

物理化学的性質

沸点
330.68 °C · 330.68°C (rough estimate)
比重(密度)
1.1444 · 1.1444 (rough estimate)
屈折率
1.5 · 1.5000 (estimate)
酸解離定数(Pka)
14.27 · 14.27±0.70(Predicted)
EPAの化学物質情報
3 · 3-Amino-4-ethoxyacetanilide (17026-81-2)

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

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.

危険有害性情報

Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)
Hazards SummaryA mutagen and tumorigen; [RTECS] Emergency treatment: Irritants; [HSDB] May cause irritation and skin sensitization; [MSDSonline]
Reactive GroupAmides and Imides
Special ReportsDHEW/NCI; Bioassay of 3-Amino-4-ethoxyacetanilide for Possible Carcinogenicity (1978) Technical Rpt Series No. 112 DHEW Pub No. (NIH) 78-1367
Reactivity Profile · 1 件

An aromatic amine and amide. 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. Organic amides/imides react with azo and diazo compounds to generate toxic gases. Flammable gases are formed by the reaction of organic amides/imides with strong reducing agents. Amides are very weak bases (weaker than water). Imides are less basic yet and in fact react with strong bases to form salts. That is, they can react as acids. Mixing amides with dehydrating agents such as P2O5 or SOCl2 generates the corresponding nitrile. The combustion of these compounds generates mixed oxides of nitrogen (NOx).

化学と産業

用途と製造

Uses · 2 件

Used as a chemical intermediate for azo dyes (possible use); Not commercially produced in the US; [HSDB]

CHEM INT FOR AZO DYES (POSSIBLE USE)

U.S. Exports · 2 件

(1977) No Data

(1979) No Data

U.S. Imports · 2 件

(1975) 6.01X10+6 GRAMS (PRINCPL CUSTMS DISTS)

(1979) No Data

U.S. Production · 2 件

(1977) NOT PRODUCED COMMERCIALLY IN US

(1979) NOT PRODUCED COMMERCIALLY IN US

General Manufacturing InformationAcetamide, N-(3-amino-4-ethoxyphenyl)-: INACTIVE

応用分野

一般的な説明Brown powder.

サプライヤー4 社

陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
赛纳斯特化学(欢迎点击联系)021-60343070
南京宁凡医药科技有限公司17368696818
Alchem Pharmtech,Inc.8485655694 · [email protected]

関連反応

0 件
反応記録を作成

現在のフィルター条件では反応記録がありません。

化合物ノート

読み込み中…

このページの内容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

データベース識別子

CAS
17026-81-2
PubChem CID
28207
DTXSID
DTXSID7020053
ChEMBL
CHEMBL1531976
UNII
8W076B0J2D
EC Number
241-100-6
Nikkaji
J33.440E
Air and Water ReactionsThis chemical may be sensitive to air and light (NTP, 1992). Insoluble in water.
Hazard Classes and CategoriesEye Irrit. 2 (100%)

安全と保護具

Fire FightingFires involving this material 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 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 a combination filter cartridge, i.e. organic vapor/acid gas/HEPA (specific for organic vapors, HCl, acid gas, SO2 and a high efficiency particulate filter). (NTP, 1992)

毒性情報

Ongoing Test Status · 1 件

The following link will take the user to the National Toxicology Program (NTP) Test Agent Search Results page, which tabulates all of the "Standard Toxicology & Carcinogenesis Studies", "Developmental Studies", and "Genetic Toxicity Studies" performed with this chemical. Clicking on the "Testing Status" link will take the user to the status (i.e., in review, in progress, in preparation, on test, completed, etc.) and results of all the studies that the NTP has done on this chemical. [http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.searchresults&searchterm=17026-81-2]

Carcinogen Classification · 6 件

3-Amino-4-ethoxyacetanilide

TR-112: Bioassay of 3-Amino-4-ethoxyacetanilide for Possible Carcinogenicity (CASRN 17026-81-2) (1978 )

04/26/78

No Evidence

No Evidence

Clear Evidence

National Toxicology Program Studies · 1 件

A bioassay of 3-amino-4-ethoxyacetanilide for possible carcinogenicity was conducted using Fischer 344 rats and B6C3F1 mice. 3-Amino-4-ethoxyacetanilide was admin in the feed, at either of two concentrations, to groups of approximately 50 male and 50 female animals of each species. The dietary concentrations used in the chronic bioassay for low and high dose rats were 0.4 and 1.5%, respectively. The dietary concentrations used for the low and high dose mice were 0.4 and 0.8%, respectively. After a 78 wk period of chemical administration, observation of rats continued for up to 35 wk and observation of mice continued for up to 18 wk. For each species, 50 animals of each sex were placed on test as controls for low dose groups and approximately 50 animals of each sex were placed on test as controls for high dose groups. ... Under the conditions of this bioassay, 3-amino-4-ethoxyacetanilide was carcinogenic in male B6C3F1 mice, causing follicular cell carcinomas of the thyroid gland. ... /Under the conditions of this study, 3-amino-4-ethoxyacetanilide was not carcinogenic in female B6C3F1 mice or in male or in female F344/N rats. {

安全データ

tsca
TSCA listed
有毒物質データの
17026-81-2(Hazardous Substances Data)