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

1,4-ビス(ジメチルアミノ)ベンゼン

N,N,N',N'-tetramethyl-p-phenylenediamine

HCID 7490
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
100-22-1
標準SMILES
CN(C)c1ccc(N(C)C)cc1
InChIKey
CJAOGUFAAWZWNI-UHFFFAOYSA-N
分子式
C10H16N2
平均分子量
164.25 g/mol
単同位体質量
164.13134852

概要

Leaflets or a drab green solid. (NTP, 1992)

名称と識別子

優先名称
N,N,N',N'-tetramethyl-p-phenylenediamine
IUPAC
1-N,1-N,4-N,4-N-tetramethylbenzene-1,4-diamine
現地名
1,4-ビス(ジメチルアミノ)ベンゼン
英語名
N,N,N',N'-Tetramethyl-1,4-phenylenediamine
分子式
C10H16N2
分子量
164.25

名称と別名

100-22-1N,N,N',N'-TETRAMETHYL-P-PHENYLENEDIAMINEWurster's reagentTetramethyl-p-phenylenediaminep-Bis(dimethylamino)benzeneTL 85DTXSID5026124p-Phenylenediamine, N,N,N',N'-tetramethyl-P4P3AC32ZBTMPD (amine)Reagents, Wurster'sTMPPD
名称をさらに表示
テトラメチル-p-フェニレンジアミンウルスター試薬N,N,N',N'-テトラメチル-1,4-フェニレンジアミンp-ビス(ジメチルアミノ)ベンゼン1,4-ビス(ジメチルアミノ)ベンゼン1,4-ジ(ジメチルアミノ)ベンゼンN,N,N',N'-テトラメチル-1,4-ベンゼンジアミンN,N,N',N'-テトラメチルベンゼン-1,4-ジアミンN,N,N',N'-テトラメチル-p-フェニレンジアミンWurster試薬N,N,N’,N’-テトラメチル-1,4-フェニレンジアミンN,N,N′,N′-テトラメチル-P-フェニレンジアミンN,N,N′,N′‐テトラメチル‐P‐フェニレンジアミンN,N,N′,N′,-テトラメチル-1,4-フェニレンジアミンN,N,N′,N′-Tetramethyl-p-phenylenediamineN1,N1,N4,N4-Tetramethylbenzene-1,4-diaminetl85WursterBlue]
N,N,N',N'-Tetramethyl-1,4-BenzenediamineDTXCID006124RefChem:926437202-831-6TMPDAn,n,n,n-tetramethyl-1,4-phenylenediamineWurster's BlueN,N,N',N'-Tetramethyl-1,4-phenylenediamine

物性

構造計算による物性

XLogP
2.6
極性表面積
6.5 Ų
水素結合供与体数
0
水素結合受容体数
2
回転可能結合数
2
重原子数
12
形式電荷
0
複雑度
108

実験および物理化学的性質

Chemical Classes · 2 件

Nitrogen Compounds -> Amines, Aromatic

Nitrogen Compounds -> Amines, Aromatic

SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Solubilityless than 1 mg/mL at 70 °F (NTP, 1992)
Flash Pointgreater than 235 °F (NTP, 1992)
Boiling Point500 °F at 760 mmHg (NTP, 1992)
Melting Point120 to 124 °F (NTP, 1992)
Vapor Pressure0.07 [mmHg]
Physical Description · 2 件

Leaflets or a drab green solid. (NTP, 1992)

Solid; [Merck Index] Drab green solid; [NTP] Grey powder; [Sigma-Aldrich MSDS]

物理化学的性質

融点
49 · 49-51 °C(lit.)
沸点
260 °C · 260 °C(lit.)
比重(密度)
0.9743 · 0.9743 (rough estimate)

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 · 6 件

Warning

H302: Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

Warning

H302 (98%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

危険有害性情報

Regulatory Information · 2 件

Chemical: 1,4-Benzenediamine, N,N,N',N'-tetramethyl-

Tetramethyl-p-phenylenediamine: Does not have an individual approval but may be used under an appropriate group standard

Fire HazardsThis chemical is probably combustible. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: When heated to decomposition this compound emits toxic fumes. It is an irritant. (NTP, 1992)
Hazards Summary · 1 件

Causes irritability and acute pulmonary edema in inhalation lethal-concentration studies of mice; [RTECS] May cause irritation; Toxic by inhalation; Harmful by ingestion and skin absorption; Targets the kidney; [Sigma-Aldrich MSDS] See N,N-Diethyl-p-phenylenediamine.

Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1 件

N,N,N',N'-TETRAMETHYL-P-PHENYLENEDIAMINE can burn in air to give toxic NOx gases (NTP, 1992). Neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.

化学と産業

用途と製造

Uses · 2 件

Used as a reagent in analytical chemistry (in the hydrochloride form); [Merck Index]

The hydrochloride form is used as a reagent in analytical chemistry; [ChemIDplus]

General Manufacturing Information1,4-Benzenediamine, N1,N1,N4,N4-tetramethyl-: ACTIVE

応用分野

使用In the form of the hydrochloride as a reagent in analytical chemistry.

一般的な説明Leaflets or a drab green solid.

調製方法 · 1 件

純化方法Crystallise the amine from pet ether or water. It can be sublimed or dried carefully in a vacuum line, and stored in the dark under nitrogen. It has been recrystallised from its melt. [Beilstein 13 H 74, 13 I 22, 13 II 40, 13 III 111, IV 107.]

上流・下流製品情報

上流原料

5-ヒドロキシトリプトファン1,4-ビス(ジメチルアミノ)ベンゼン

サプライヤー1 社

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]

関連反応

1 件
反応記録を作成
HRID 1500127 の反応式
HRID 1500127反応物としてuspto-grants-2015_12

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
100-22-1、27215-51-6
PubChem CID
7490
DTXSID
DTXSID201370133
ChEMBL
CHEMBL1393325
UNII
P4P3AC32ZB
EC Number
202-831-6
Nikkaji
J4.980H
屈折率
1.57 · 1.5700 (estimate)
闪点
230 °F · >230 °F
貯蔵温度
30 °C · Store below +30°C.
外見
粉
酸解離定数(Pka)
5.92 · 5.92±0.12(Predicted)
色
オフホワイトからグレー
水溶解度
冷水でやや、熱湯でより多く
Merck
14 · 14,9228
BRN
1564025 · 1564025
安定性
安定していますが、空気や光に敏感な場合があります。可燃性。酸、酸塩化物、酸無水物、酸化剤とは混和しません。
InChI
1S/C10H16N2/c1-11(2)9-5-7-10(8-6-9)12(3)4/h5-8H,1-4H3
InChIKey
CJAOGUFAAWZWNI-UHFFFAOYSA-N
SMILES
CN(C)c1ccc(cc1)N(C)C
CAS データベース
100 · 100-22-1(CAS DataBase Reference)
NISTの化学物質情報
1 · 1,4-Benzenediamine, N,N,N',N'-tetramethyl-(100-22-1)
EPAの化学物質情報
N,N,N',N'-Tetramethyl-p-phenylenediamine (100-22-1)

化学的性質

化学的特性purple to brown crystalline powder

Air and Water ReactionsThis compound may be sensitive to air and heat. (NTP, 1992). Insoluble in water.
Hazard Classes and Categories · 3 件

Acute Tox. 4 (98%)

Acute toxicity - category 4

Acute Tox. 4 *

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 an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

毒性情報

Toxicity DataLCLo (mouse) = 780 mg/m3/10min

安全データ

F
10
wgk
1
tsca
TSCA listed
rtecs
ST4200000
ridadr
UN 2811 6.1/PG 3
毒性
LD50 oral in bird - wild: 23700ug/kg
hs_code
29215190
risk_code
20/21/22-40-36/37/38
hazard_code
Xn
safety_code
28-28A-36-26-22
hazard_class
6.1(a)
packing_group
II
Hazard Classifications
Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 Oral
ストレージクラス
11 - Combustible Solids