N-ブチルアニリン

N-Butylaniline

HCID 14310CAS 1126-78-9

基本情報

標準SMILES
CCCCNc1ccccc1
InChIKey
VSHTWPWTCXQLQN-UHFFFAOYSA-N
分子式
C10H15N
平均分子量
149.23 g/mol
単同位体質量
149.12044948

概要

N-butylaniline appears as an amber colored liquid. Slightly denser than water and insoluble in water. May be toxic by skin absorption and ingestion. Severely irritates skin and eyes. Used to make dyes.

名称と識別子

優先名称
N-Butylaniline
IUPAC
N-butylaniline
現地名
N-ブチルアニリン
英語名
N-Phenyl-n-butylamine
分子式
C10H15N
分子量
149.23

名称と別名

N-Butylaniline1126-78-9Benzenamine, N-butyl-N-ButylbenzenamineAniline, N-butyl-4-(Phenylamino)butaneN-(N-BUTYL)ANILINEbutylphenylamineN-PhenylbutylamineNSC 7114Benzamine, N-butyl-UN2738
名称をさらに表示
N-ブチルアニリンブチルフェニルアミンフェニルブチルアミンN-フェニルブチルアミンN-フェニルブタン-1-アミンN-ブチルベンゼンアミンブチルアニリンN-N-ブチルアニリンNブチルアニリンN‐N‐ブチルアニリンフェニル-n-ブチルアミンN-Butylanlinen-butyl-anilinN-N-BUTYLANILINEn-butyl-benzenaminPhenyln-butylamine
DTXSID9044370UNII-R2ZNJ7L2UMR2ZNJ7L2UMNSC-7114EINECS 214-425-6BRN 2206226AI3-15307DTXCID7024370

データベース識別子

CAS
1126-78-9
PubChem CID
14310
DTXSID
DTXSID9044370
ChEMBL
CHEMBL3187651
UNII
R2ZNJ7L2UM
EC Number
214-425-6
Nikkaji
J1.760D

物性

構造計算による物性

XLogP
2.8
極性表面積
12 Ų
水素結合供与体数
1
水素結合受容体数
1
回転可能結合数
4
重原子数
11

実験および物理化学的性質

SpringerMaterials PropertiesBoiling point
LogP3.58
Physical DescriptionN-butylaniline appears as an amber colored liquid. Slightly denser than water and insoluble in water. May be toxic by skin absorption and ingestion. Severely irritates skin and eyes. Used to make dyes.

物理化学的性質

融点
-12 °C · -12 °C
沸点
241 °C · 241 °C
比重(密度)
0.93 · 0.93
屈折率
1.5325 · 1.5325-1.5345
闪点
107 °C · 107 °C
酸解離定数(Pka)
5.05 · 5.05±0.20(Predicted)

化学的性質

化学的特性CLEAR LIGHT YELLOW TO YELLOW-ORANGE LIQUID

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P308+P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 99 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 2 件

Chemical: Benzenamine, N-butyl-

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.)

DOT LabelPoison
Fire Hazards · 2 件

Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

· Combustible material: may burn but does not ignite readily.

Health Hazards · 2 件

Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

· TOXIC and/or CORROSIVE; inhalation, ingestion or skin contact with material may cause severe injury or death.

DOT ID and Guide2738 153
Reactive GroupAmines, Aromatic

安全と保護具

Fire FightingExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
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.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2 件

Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Isolation and Evacuation · 2 件

Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:

Immediate precautionary measure

安全データ

tsca
TSCA listed
rtecs
BW9450000
ridadr
UN 2738
hs_code
2921420090
risk_code
20/22-36/37/38-22
化審法
(3)-118, (3)-206

化学と産業

用途と製造

General Manufacturing InformationBenzenamine, N-butyl-: ACTIVE
応用分野 · 3 件

用途有機合成原料。

使用N-Butylaniline is used in preparation of Cyano Tertiary Amine.

一般的な説明An amber colored liquid. Slightly denser than water and insoluble in water. May be toxic by skin absorption and ingestion. Severely irritates skin and eyes. Used to make dyes.

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]
阿诺西(上海)生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖北成丰化工有限公司13125175253 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]

関連反応

17 件

関連ノート

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