154927-01-2 (1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛,1-Methyl-5-phenyl-1H-pyrazole-4-carbaldehyde)

CAS号:
154927-01-2
中文名称:
1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛
英文名称:
1-Methyl-5-phenyl-1H-pyrazole-4-carbaldehyde
分子式:
C11H10N2O
分子量:
186.20990228653

1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛(154927-01-2)名称与标识符

名称

中文别名:
1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛;1-甲基-5-苯基-1H-吡唑-4-甲醛;
英文别名:
1-Methyl-5-phenyl-1H-pyrazole-4-carbaldehyde;1H-Pyrazole-4-carboxaldehyde,1-methyl-5-phenyl-;1-methyl-5-phenylpyrazole-4-carbaldehyde;1-Methyl-5-phenyl-pyrazole-4-carbaldehyde;1-Methyl-5-phenyl-1H-pyrazole-4-carboxaldehyde;EN300-155262;MS-22188;1-Methyl-5-phenyl-1H-pyrazole-4-carbaldehyde, AldrichCPR;1H-Pyrazole-4-carboxaldehyde, 1-methyl-5-phenyl-;154927-01-2;FT-0608074;MFCD04115389;A26136;W-205773;AKOS005169539;DTXSID90383697;CS-0309075;SCHEMBL4836837;Z808584864;STL411794;

标识符

MDL:
MFCD04115389
InChIKey:
DLMVCAXLQMJYHP-UHFFFAOYSA-N
Inchi:
1S/C11H10N2O/c1-13-11(10(8-14)7-12-13)9-5-3-2-4-6-9/h2-8H,1H3
SMILES:
O=CC1C=NN(C)C=1C1C=CC=CC=1

1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛(154927-01-2)物化性质

实验特性

  • LogP : 1.89960
  • PSA : 34.89000
  • 折射率 : 1.593
  • 沸点 : 356.4°Cat760mmHg
  • 熔点 : 700℃
  • 闪点 : 169.4°C
  • 溶解度 : Very 微溶 (0.19 g/L) (25 ºC),
  • 密度 : 1.13±0.1 g/cm3 (20 ºC 760 Torr),

计算特性

  • 精确分子量 : 186.07900
  • 氢键供体数量 : 0
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 2
  • 同位素质量 : 186.079
  • 重原子数量 : 14
  • 复杂度 : 202
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 1.4
  • 拓扑分子极性表面积 : 34.9A^2

1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛(154927-01-2)安全信息

1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛(154927-01-2)海关数据

海关编码:
2933199090
海关数据:

中国海关编码:

2933199090

概述:

2933199090. 其他结构上有非稠合吡唑环化合物. 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, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期

Summary:

2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛(154927-01-2)推荐厂家 更多厂家(8)

1 -甲基- 5 -苯基- 1H -吡唑-4-甲醛(154927-01-2) MSDS

基础信息

Name:1-Methyl-5-phenyl-1H-pyrazole-4-carbaldehyde Material Safety Data Sheet
Synonym:None Known
CAS:154927-01-2
Section 1 - Chemical Product ? MSDS Name:1-Methyl-5-phenyl-1H-pyrazole-4-carbaldehyde Material Safety Data Sheet
Synonym:None Known

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
154927-01-21-Methyl-5-phenyl-1H-pyrazole-4-carbal95+unlisted
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
Chronic:
No information found.

Section 4 - FIRST AID MEASURES
? Eyes: In case of contact, immediately flush eyes with plenty of water for at least 15 minutes. Get medical aid.
Skin:
In case of contact, flush skin with plenty of water. Remove contaminated clothing and shoes. Get medical aid if irritation develops and persists. Wash clothing before reuse.
Ingestion:
If swallowed, do not induce vomiting unless directed to do so by medical personnel. Never give anything by mouth to an unconscious person. Get medical aid.
Inhalation:
If inhaled, remove to fresh air. 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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Clean up spills immediately, observing precautions in the Protective Equipment section. Sweep up or absorb material, then place into a suitable clean, dry, closed container for disposal. Avoid generating dusty conditions. Provide ventilation.

Section 7 - HANDLING and STORAGE
? Handling:
Wash thoroughly after handling. Use with adequate ventilation.
Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

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# 154927-01-2: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Solid
Color: white
Odor: slight
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 101.5-104.5 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: C11H10N2O
Molecular Weight: 186.21

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Dust generation, excess heat.
Incompatibilities with Other Materials:
Oxidizing agents, reducing agents.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 154927-01-2 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1-Methyl-5-phenyl-1H-pyrazole-4-carbaldehyde - 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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 6 Keep under nitrogen.
S 22 Do not breathe dust.
S 24/25 Avoid contact with skin and eyes.
S 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
WGK (Water Danger/Protection)
CAS# 154927-01-2: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 154927-01-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 154927-01-2 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A