2-(乙酰氨基)-3-硝基苯甲酸甲酯

2-(乙酰氨基)-3-硝基苯甲酸甲酯 基本信息
CAS号 95067-27-9 分子式 C10H10N2O5
分子量 238.19700 精确质量 　238.05900
PSA 　101.22000 LogP 　1.93600
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目录
基本信息 物化性质 安全信息 合成路线 MSDS 海关数据 上下游

基本信息 展开↓

CAS号：
95067-27-9
分子式：
C10H10N2O5
分子量：
238.19700
中文名称：
2-(乙酰氨基)-3-硝基苯甲酸甲酯
英文名称：
methyl 2-acetamido-3-nitrobenzoate
中文别名：
2-(乙酰氨基)-3-硝基苯甲酸甲酯;
(1S)-2-hydroxy-1,2,2-triphenylethyl acetate;
1,2-ethanediol, 1,1,2-triphenyl-, 2-acetate, (2R)-;
95061-47-5;
2''-DEOXY-2'',2''-DIFLUOROCYTIDINE(GEMCITABINE);
Gemcitabine Base;
2'-deoxy-2',2'-difluorocytidine;
Gecitabine base;
4-Amino-1-[3,3-difluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one(Gemcitabine Base);
Gemcitabine;
Phenoxy-terminated tetrabromobisphenol-A carbonate oligomer;
bromochloroparrafin;
Phenoxy-terminated Carbonate oligomer of tetrabromobisphenol A;
Phenoxy-Terminated Carbonate Oligomer of Tetrabromobisphenol A(FR-52);
(R)-2-(4-Hydroxyphenoxy) propionic acid;
(R)-(+)-2-(4-Hydroxy Phenoxy)propionic acid
英文别名：
methyl 2-acetamido-3-nitrobenzoate;
2-(Acetylamino)-3-Nitro-Benzoic Acid Methyl Ester;
methyl 2-acetamido-3-nitro-benzoate;
methyl ester of 2-acetoamino-3-nitrobenzoic acid;
METHYL 2-(ACETYLAMINO)-3-NITROBENZOATE
精确分子量/精确质量：
238.05900
极性分子表面积/PSA：
101.22000
油水分配系数/LogP：

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值，反映了物质在油水两相中的分配情况。其中、LogP值越大，说明该物质越亲油；反之，LogP值越小，则说明该物质越亲水。
InChI：
InChI=1/C10H10N2O5/c1-6(13)11-9-7(10(14)17-2)4-3-5-8(9)12(15)16/h3-5H,1-2H3,(H,11,13)

物化性质展开↓

密度：
1.382g/cm3
熔点：
121-122ºC
沸点：
451.3ºC at 760mmHg
闪点：
226.7ºC
折射率：
1.598

安全信息展开↓

海关代码：
2924299090
危险类别码：
20/21/22
安全说明：
22-24/25

合成路线查看所有的合成路线

  • 108-24-7

    乙酸酐

  • +

  • 134-20-3

    氨茴酸甲酯

  • →

    ~52%

  • 95067-27-9

    2-(乙酰氨基)-3-硝基苯甲酸甲酯

  • 2719-08-6

    2-乙酰苯甲酸甲酯

  • →

  • 5409-45-0

    2-乙酰氨基-5-硝基苯甲酸甲酯

  • +

  • 95067-27-9

    2-(乙酰氨基)-3-硝基苯甲酸甲酯

MSDS 展开↓

Name: Methyl 2-(acetylamino)-3-nitrobenzoate 90+% Material Safety Data Sheet
Synonym: Methyl 2-acetamido-3-nitrobenzoat
CAS: 95067-27-9
Section 1 - Chemical Product   MSDS Name:Methyl 2-(acetylamino)-3-nitrobenzoate 90+% Material Safety Data Sheet
Synonym:Methyl 2-acetamido-3-nitrobenzoat
Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
95067-27-9 Methyl 2-(acetylamino)-3-nitrobenzoate 90+% unlisted
Hazard Symbols: XI
Risk Phrases: 36/37/38
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.
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.
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 water spray, dry chemical, carbon dioxide, or chemical foam.
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.
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.
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# 95067-27-9: 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.
Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
 
Physical State: Solid
Color: off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 120 - 122 deg C
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: C10H10N2O5
Molecular Weight: 238
Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported
Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 95067-27-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Methyl 2-(acetylamino)-3-nitrobenzoate - Not listed by ACGIH, IARC, or NTP.
Section 12 - ECOLOGICAL INFORMATION
 
Section 13 - DISPOSAL CONSIDERATIONS
  Dispose of in a manner consistent with federal, state, and local regulations.
Section 14 - TRANSPORT INFORMATION
 
IATA
No information available.
IMO
No information available.
RID/ADR
No information available.
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# 95067-27-9: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 95067-27-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 95067-27-9 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A

海关数据查看详细

中国海关编码：2924299090

概述：
2924299090. 其他环酰胺（包括环氨基甲酸酯）（包括其衍生物以及他们的盐）. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:30.0%
申报要素：
品名, 成分含量, 用途, 包装
摘要/Summary：
2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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