2-(5-甲基-2-苯基1,3-氧杂醇-4-烷基)乙酸

2-(5-甲基-2-苯基1,3-氧杂醇-4-烷基)乙酸 基本信息
CAS号 107367-98-6 分子式 C12H11NO3
分子量 217.22100 精确质量  217.07400
PSA  63.33000 LogP  2.27710

基本信息 展开↓

CAS号:
107367-98-6
3D弹球模型:
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分子式:
C12H11NO3
分子量:
217.22100
中文名称:
2-(5-甲基-2-苯基1,3-氧杂醇-4-烷基)乙酸
英文名称:
2-(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)ACETIC ACID
中文别名:
2-(5-甲基-2-苯基1,3-氧杂醇-4-烷基)乙酸;
2-(5-甲基-2-苯基-1,3-氧唑)乙酸;
2-(5-甲基-2-苯基-1,3-噁唑-4-基)乙酸
英文别名:
2-(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)ACETIC ACID;
2-Phenyl-5-methyloxazol-4-ylacetic acid;
2-(3,5-DIMETHYL-PYRAZOL-1-YL)-BUTYRIC ACID;
(5-methyl-2-phenyl-oxazol-4-yl)-acetic acid;
(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetic acid;
2-(5-Methyl-2-phenyl-4-oxazolyl)-acetic acid;
4-(2-phenyl-5-methyl)-oxazolyl-acetic acid;
2-(5-methyl-2-phenyloxazol-4-yl)acetic acid
精确分子量/精确质量:
217.07400
极性分子表面积/PSA:
63.33000
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:
The Key: XEWJNPORMBGGKZ-UHFFFAOYSA-N

物化性质展开↓

密度:
1.245g/cm3
熔点:
131ºC
沸点:
411.7ºC at 760mmHg
闪点:
202.8ºC
折射率:
1.569
蒸汽压:
1.63E-07mmHg at 25°C

安全信息展开↓

海关代码:
2934999090
危险类别码:
R36/37/38
安全说明:
26-36/37/39
危险标志:
Xi: Irritant;

合成路线查看所有的合成路线

  • 103788-64-3

    2-(5-甲基-2-苯基-1,3-噁唑-4-基)乙酸甲酯

  • ~79%

  • 107367-98-6

    2-(5-甲基-2-苯基1,3-氧杂醇-4-烷基)乙酸

  • 524959-64-6

    524959-64-6

  • ~61%

  • 107367-98-6

    2-(5-甲基-2-苯基1,3-氧杂醇-4-烷基)乙酸

  • 258346-54-2

    258346-54-2

  • ~43%

  • 107367-98-6

    2-(5-甲基-2-苯基1,3-氧杂醇-4-烷基)乙酸

MSDS 展开↓

Name: 2-(5-Methyl-2-phenyl-1 3-oxazol-4-yl)acetic acid 97% Material Safety Data Sheet
Synonym:
CAS: 107367-98-6
Section 1 - Chemical Product   MSDS Name:2-(5-Methyl-2-phenyl-1 3-oxazol-4-yl)acetic acid 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
107367-98-6 2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)a 97% 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# 107367-98-6: 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: tan
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 122 - 123 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: C12H11NO3
Molecular Weight: 217

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# 107367-98-6 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)acetic acid - 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# 107367-98-6: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 107367-98-6 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 107367-98-6 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:2934999090

概述:
2934999090. 其他杂环化合物. 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:20.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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