4-氨基苯甲酰苯胺 | 17625-83-1

• 物质功能分类: 有机原料 - 氨基化合物
• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 4-氨基苯甲酰苯胺
• 中文别名: 4-氨基苯酰苯胺；红色基DB-90；对氨基苯甲酰苯胺；4-氨基苯甲酰替苯胺；4′-苯甲酰胺基苯胺；对氨基苯酰替苯胺；4-氨基萘氨；4'-氨基苯甲酰苯胺；4-苯甲酰胺基苯胺
• 英文名称: N-(4-aminophenyl)benzamide
• 英文别名: 4’-aminobenzanilide；4'-Aminobenzanilide
• CAS: 17625-83-1
• 化学式: C₁₃H₁₂N₂O
• mdl: MFCD00035777
• 分子量: 212.251
• InChiKey: GTTFJYUWPUKXJH-UHFFFAOYSA-N

物化性质

• 熔点：
  127-131 °C(lit.)
• 沸点：
  308.6±25.0 °C(Predicted)
• 密度：
  1.244±0.06 g/cm3(Predicted)
• 溶解度：
  溶于二甲基亚砜和甲醇。
• 稳定性/保质期：

  常温常压下稳定，应避免与氧化物接触。

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  55.1
• 氢给体数：
  2
• 氢受体数：
  2

安全信息

• TSCA：
  Yes
• 危险等级：
  IRRITANT
• 危险品标志：
  Xi
• 危险类别码：
  R36/37/38
• WGK Germany：
  3
• 海关编码：
  2924299090
• 危险类别：
  IRRITANT
• 安全说明：
  S26,S36
• 危险性防范说明：
  P261,P305+P351+P338
• 危险性描述：
  H315,H319,H335
• 储存条件：
  常温下应密闭避光保存，并保持通风和干燥。

SDS

Name:	N-Benzoylphenylenediamine 98% Material Safety Data Sheet
Synonym:	1-Amino-4-benzoylaminobenzen
CAS:	17625-83-1

Section 1 - Chemical Product MSDS Name:N-Benzoylphenylenediamine 98% Material Safety Data Sheet
Synonym:1-Amino-4-benzoylaminobenzen

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
17625-83-1	N-Benzoylphenylenediamine	98%	241-603-0

Hazard Symbols: XI
Risk Phrases: 36/37/38

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes respiratory tract irritation. May be harmful if inhaled.
Chronic:
Not available.

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Section 4 - FIRST AID MEASURES
Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:
Treat symptomatically and supportively.

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Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.

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Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

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Section 7 - HANDLING and STORAGE
Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

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Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 17625-83-1: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

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Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Solid
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C13H12N2O
Molecular Weight: 212.25

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Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents, acids, acetic anhydride, acid chlorides, carbon dioxide.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 17625-83-1 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
N-Benzoylphenylenediamine - Not listed by ACGIH, IARC, or NTP.

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Section 12 - ECOLOGICAL INFORMATION

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Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

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Section 14 - TRANSPORT INFORMATION

IATA
No information available.
IMO
No information available.
RID/ADR
No information available.

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Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 17625-83-1: 2
Canada
CAS# 17625-83-1 is listed on Canada's NDSL List.
CAS# 17625-83-1 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 17625-83-1 is listed on the TSCA inventory.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

制备方法与用途

用途
主要用作医药和染料中间体
用途
主要用于重要的染料中间体
用途
用于有机合成的中间体

反应信息

• 作为反应物：
  描述：

  4-氨基苯甲酰苯胺 在 盐酸 、 sodium nitrite 、 sodium azide 、 sodium acetate 作用下， 以 水 为溶剂， 反应 1.67h， 生成 N-(4-azidophenyl)benzamide
  参考文献：
  名称：

  α-降钙素衍生的乙酰基磺酸三唑衍生物的合成及其对T细胞和B细胞增殖的生物评价

  摘要：

  使用Huisgen 1,3-偶极环加成反应（点击化学方法）合成了一系列新的α-桑顿酸衍生的乙酰基桑地酸1,2,3-三唑衍生物，并评估了其对伴刀豆球蛋白A（ConA）的体外抑制活性。 ）诱导T细胞增殖，而脂多糖（LPS）诱导B细胞增殖。在合成的系列中，化合物2-10和19对ConA和LPS刺激的T细胞和B细胞增殖呈剂量依赖性显着抑制作用。更重要的是化合物4，9-10和19浓度为1μM时，对有丝分裂原诱导的T细胞和B细胞增殖具有较强的抑制活性，且细胞毒性显着降低。化合物6在100μM浓度下对LPS诱导的B细胞具有约89％的有效免疫抑制作用，对ConA刺激的T细胞增殖有约83％的抑制作用，而无细胞毒性。化合物10对B细胞的增殖更具选择性，在100和1μM的浓度下分别表现出81％和69％的抑制作用。本研究导致鉴定出几种具有降低的细胞毒性和对有丝分裂原诱导的细胞增殖具有强抑制活性的桑托宁类似物。

  DOI：

  10.1016/j.ejmech.2016.05.018
• 作为产物：
  描述：

  N-(4’-acetamidophenyl)benzamide 在 三氟化硼甲醇络合物 、 氨 作用下， 以 甲醇 、 水 为溶剂， 反应 3.0h， 以83%的产率得到4-氨基苯甲酰苯胺
  参考文献：
  名称：

  三氟化硼-甲醇络合物。温和而强大的试剂，可用于脱保护乙酰基胺。范围和选择性

  摘要：

  三氟化硼-甲醇络合物在对乙酰苯胺的脱乙酰作用中对常用的氨基保护基团表现出显着的脱保护选择性，并对底物的空间位阻高度敏感。探索了反应的范围和局限性。

  DOI：

  10.1016/j.tetlet.2015.12.087