175277-88-0 (4-甲基-3-氟苯甲脒盐酸盐,3-Fluoro-4-methylbenzenecarboximidamidehydrochloride)

CAS号:
175277-88-0
中文名称:
4-甲基-3-氟苯甲脒盐酸盐
英文名称:
3-Fluoro-4-methylbenzenecarboximidamidehydrochloride
分子式:
C8H10ClFN2
分子量:
188.629804134369

4-甲基-3-氟苯甲脒盐酸盐(175277-88-0)名称与标识符

名称

中文别名:
3-氟-4-甲苯基-1-羰基咪唑胺盐酸盐;3-氟-4-甲基氯化苯甲硫胺;4-甲基-3-氟苯甲脒盐酸盐;3-氟-4-甲基苯甲脒盐酸盐;
英文别名:
3-Fluoro-4-methylbenzimidamide hydrochloride;3-FLUORO-4-METHYLBENZAMIDINE HYDROCHLORIDE;3-fluoro-4-methylbenzene-1-carboximidamide hydrochloride;3-Fluoro-4-methylbenzenecarboximidamide hydrochloride;Benzenecarboximidamide,3-fluoro-4-methyl-, hydrochloride (1:1);3-fluoro-4-methylbenzenecarboxamidine,chloride;3-Fluoro-4-methylbenzamidine HCl;3-Fluoro-4-methylbenzenecarboximidamide hydrochloride, 4-Carbamimidoyl-2-fluorotoluene hydrochloride;3-Fluoro-4-methylbenzamidinehydrochloride97%;3-Fluoro-4-methylbenzamidine hydrochloride 97%;3-FLUORO-4-METHYLBENZENECARBOXIMIDAMIDEHYDROCHLORIDE;3-fluoro-4-methylbenzenecarboxamidine, chloride;C8H10ClFN2;PC3822J;VXAQJXKADWRKGS-UHFFFAOYSA-N;SBB055500;5833AD;VZ26823;ST50949978;Z1741959288;C73347;3-Fluoro-4-methylbenzimidamidehydrochloride;FT-0615691;SCHEMBL1435908;3-FLUORO-4-METHYLBENZIMIDAMIDE HCL;3-fluoro-4-methylbenzenecarboximidamide;hydrochloride;SY063149;A812027;Benzenecarboximidamide, 3-fluoro-4-methyl-, hydrochloride (1:1);EN300-6736437;3-fluoro-4-methylbenzamidine hydrochloride, AldrichCPR;3-fluoranyl-4-methyl-benzenecarboximidamide hydrochloride;CS-0141560;175277-88-0;[amino-(3-fluoro-4-methylphenyl)methylidene]azanium;chloride;AKOS015912039;3-Fluoro-4-methylbenzene-1-carboximidamide--hydrogen chloride (1/1);MFCD00275569;SR-01000635646-1;DS-15317;DTXSID30586589;CCG-45909;3-Fluoro-4-methyl-benzamidine hydrochloride;DB-015539;

标识符

MDL:
MFCD00275569
InChIKey:
VXAQJXKADWRKGS-UHFFFAOYSA-N
Inchi:
1S/C8H9FN2.ClH/c1-5-2-3-6(8(10)11)4-7(5)9;/h2-4H,1H3,(H3,10,11);1H
SMILES:
Cl.FC1C=C(C(=N)N)C=CC=1C

4-甲基-3-氟苯甲脒盐酸盐(175277-88-0)物化性质

实验特性

  • LogP : 3.02020
  • PSA : 49.87000
  • 沸点 : 228.9°C at 760 mmHg
  • 熔点 : 165 °C
  • 颜色与性状 : 未确定
  • 溶解性 : 未确定

计算特性

  • 精确分子量 : 188.05200
  • 氢键供体数量 : 3
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 1
  • 同位素质量 : 188.0516542g/mol
  • 重原子数量 : 12
  • 复杂度 : 158
  • 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 : 2
  • 疏水参数计算参考值(XlogP) : 无
  • 互变异构体数量 : 3
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 49.9

4-甲基-3-氟苯甲脒盐酸盐(175277-88-0)海关数据

海关编码:
2925290090
海关数据:

中国海关编码:

2925290090

概述:

2925290090 其他亚胺及其衍生物,以及它们的盐。监管条件:无。增值税率:17.0%。退税率:9.0%。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

Summary:

2925290090 other imines and their derivatives; salts thereof。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

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4-甲基-3-氟苯甲脒盐酸盐(175277-88-0) MSDS

基础信息

Name:3-Fluoro-4-methylbenzene-1-carboximidamide hydrochloride 97% Material Safety Data Sheet
Synonym:3-Fluoro-4-methylbenzamidine hydrochlorid
CAS:175277-88-0
Section 1 - Chemical Product ? MSDS Name:3-Fluoro-4-methylbenzene-1-carboximidamide hydrochloride 97% Material Safety Data Sheet
Synonym:3-Fluoro-4-methylbenzamidine hydrochlorid

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
175277-88-03-Fluoro-4-methylbenzene-1-carboximida97%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# 175277-88-0: 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: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 165 - 167 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: C8H10ClFN2
Molecular Weight: 189

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Oxidizing agents, reducing agents, bases.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, nitrogen oxides, carbon monoxide, carbon dioxide, fluorine, hydrogen fluoride gas.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 175277-88-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
3-Fluoro-4-methylbenzene-1-carboximidamide hydrochloride - 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# 175277-88-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 175277-88-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 175277-88-0 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A